SCHEMBL6782129

SCHEMBL6782129

COc1cc(OC)cc(C2NCCc3c2[nH]c2ccccc32)c1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.82
CYP3A4 P08684 1/20 0.67
CYP2D6 P10635 1/20 0.67
CYP2C19 P33261 1/20 0.67
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
DRD2 P14416 2/20 0.60
PRMT5 O14744 6/20 0.59
CHRM4 P08173 1/20 0.58
RAD52 P43351 1/20 0.58
EGFR P00533 3/20 0.57
MAPT P10636 2/20 0.57
MAPK1 P28482 1/20 0.57
OXTR P30559 1/20 0.57
AVPR1A P37288 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
HTR2A P28223 2/20 0.54
HTR2C P28335 2/20 0.54
ALDH1A1 P00352 1/20 0.53
HTR2B P41595 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL538174 0.88 HTR7 (0.76) HTR7CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL6779743 0.85 KMT2A (0.68) HTR7CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL6407779 0.82 KMT2A (0.82) HTR7KMT2AMEN1PRMT5RAD52
SCHEMBL763727 0.81 HTR7 (0.72) HTR7CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL765058 0.81 HTR7 (0.72) HTR7CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL6785201 0.81 HTR2C (0.73) HTR7KMT2AMEN1DRD2PRMT5
SCHEMBL2725785 0.81 HTR2C (0.73) HTR7KMT2AMEN1DRD2PRMT5
SCHEMBL274149 0.81 HTR7 (1.00) HTR7CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL7488649 0.80 PRMT5 (0.72) HTR7CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL30274351 0.79 HTR2A (0.74) HTR7CYP3A4CYP2D6CYP2C19KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043422-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. (US) 2024-02-08 US disclosed
US-11613538-B2 Method of inhibiting or reducing a viral infection PTC THERAPEUTICS, INC. (US) 2023-03-28 US disclosed
EP-2434891-B9 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2021-05-05 EP disclosed
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION PTC THERAPEUTICS, INC. 2020-10-08 US disclosed
EP-3718405-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC Therapeutics, Inc. (US) 2020-10-07 EP disclosed
EP-2434891-B1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2020-07-22 EP disclosed
US-20190194188-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2019-06-27 US disclosed
CN-106167488-A Treatment cancer and the method for non-neoplastic conditions PTC医疗公司 2016-11-30 CN disclosed
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2016-11-24 US disclosed
US-9351964-B2 Methods for treating cancer and non-neoplastic conditions PTC THERAPEUTICS, INC. (US) 2016-05-31 US disclosed
US-8697662-B2 Methods for treating Kaposi sarcoma PTC THERAPEUTICS, INC. (US) 2014-04-15 US disclosed
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS PTC THERAPEUTICS, INC. (US) 2013-07-04 US disclosed
US-20120202801-A1 METHODS FOR TREATING BREAST CANCER PTC THERAPEUTICS, INC. 2012-08-09 US disclosed
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC (US) 2012-08-09 US disclosed
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS PTC THERAPEUTICS, INC. 2012-07-12 US disclosed
US-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157401-A1 METHODS FOR TREATING NEUROFIBROMATOSIS PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-6720331-B2 HAVING ANTI-MITOTIC ACTIVITY FOR THERAPY OF CANCER NATIONAL SUN YAT-SEN UNIVERSITY (TW) 2004-04-13 US disclosed
US-20030040527-A1 1-substituted 1,2,3,4-tetrahydro-beta-carboline and 3,4-dihydro-beta-carboline and analogs as antitumor agents NATIONAL SUN YAT-SEN UNIVERSITY (TW) 2003-02-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS HDGF, VEGFA, FLT4 HTR7 1580/4885CYP3A4 4761/4885CYP2D6 4842/4885
US-20030040527-A1 1-substituted 1,2,3,4-tetrahydro-beta-carboline and 3,4-dihydro-beta-carboline and analogs as antitumor agents DCK, CCR1, CCNT1 HTR7 928/4885CYP3A4 524/4885CYP2D6 110/4885
US-20240043422-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA HTR7 4366/4885CYP3A4 4614/4885CYP2D6 4809/4885
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA HTR7 4356/4885CYP3A4 4613/4885CYP2D6 4803/4885
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA HTR7 4356/4885CYP3A4 4613/4885CYP2D6 4803/4885
US-20190194188-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA HTR7 4356/4885CYP3A4 4613/4885CYP2D6 4803/4885
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION SARS1, POLRMT, EIF2AK2 HTR7 4102/4885CYP3A4 2221/4885CYP2D6 3664/4885
US-20120157401-A1 METHODS FOR TREATING NEUROFIBROMATOSIS VHL, NGF, VEGFA HTR7 3489/4885CYP3A4 4879/4885CYP2D6 4864/4885
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS EIF2AK2, POLRMT, POLM HTR7 4338/4885CYP3A4 4400/4885CYP2D6 4700/4885
US-11613538-B2 Method of inhibiting or reducing a viral infection SARS1, EIF2AK2, POLRMT HTR7 3935/4885CYP3A4 3112/4885CYP2D6 4147/4885
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA HDGF, HIF1AN, VEGFA HTR7 4420/4885CYP3A4 4485/4885CYP2D6 4660/4885
US-20120202801-A1 METHODS FOR TREATING BREAST CANCER VEGFA, FLT4, FLT1 HTR7 2821/4885CYP3A4 4548/4885CYP2D6 4792/4885
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS ACP3, BPHL, PTGFR HTR7 1813/4885CYP3A4 3553/4885CYP2D6 4409/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.