SCHEMBL14880207

SCHEMBL14880207

COC(=O)C1CCc2[nH]c3ccc(F)cc3c2C1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
HTR1F P30939 1/20 0.51
HTR1B P28222 3/20 0.50
HTR1A P08908 3/20 0.50
HTR1D P28221 2/20 0.50
BAZ2B Q9UIF8 1/20 0.50
SLC6A4 P31645 1/20 0.49
VPS4B O75351 1/20 0.48
VCP P55072 1/20 0.48
BRD3 Q15059 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL4895642 0.87 KMT2A (0.51) KMT2AMEN1HTR1FHTR1BHTR1A
SCHEMBL14880114 0.86 HTR1B (0.65) KMT2AMEN1HTR1BHTR1AHTR1D
SCHEMBL4897652 0.85 HTR1B (0.52) KMT2AMEN1HTR1FHTR1BHTR1A
SCHEMBL4895910 0.85 HTR1B (0.52) KMT2AMEN1HTR1FHTR1BHTR1A
SCHEMBL4899304 0.85 HTR1B (0.52) KMT2AMEN1HTR1FHTR1BHTR1A
SCHEMBL4899779 0.85 SIRT1 (0.60) KMT2AMEN1HTR1FHTR1BHTR1A
SCHEMBL4903633 0.85 SIRT1 (0.60) KMT2AMEN1HTR1FHTR1BHTR1A
SCHEMBL30523188 0.83 KDM4E (0.63) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL30523189 0.83 KDM4E (0.63) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL4728062 0.83 KDM4E (0.63) KMT2AMEN1KDM4EALDH1A1MAPT

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11738004-B2 Indomethacin analogs for the treatment of castrate-resistant prostate cancer VANDERBILT UNIVERSITY (US) 2023-08-29 US disclosed
US-20210251960-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER VANDERBILT UNIVERSITY (US) 2021-08-19 US disclosed
US-20190350903-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER VANDERBILT UNIVERSITY (US) 2019-11-21 US disclosed
US-10398678-B2 Indomethacin analogs for the treatment of castrate-resistant prostate cancer VANDERBILT UNIVERSITY (US) 2019-09-03 US disclosed
EP-3078374-B1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER UNIV VANDERBILT (US) 2019-06-19 EP disclosed
US-20180271835-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER VANDERBILT UNIVERSITY (US) 2018-09-27 US disclosed
US-9895351-B2 Indomethacin analogs for the treatment of castrate-resistant prostate cancer VANDERBILT UNIVERSITY (US) 2018-02-20 US disclosed
US-20160303082-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER VANDERBILT UNIVERSITY 2016-10-20 US disclosed
EP-3078374-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER Vanderbilt University (US) 2016-10-12 EP disclosed
US-9346803-B2 Indomethacin analogs for the treatment of castrate-resistant prostate cancer VANDERBILT UNIVERSITY (US) 2016-05-24 US disclosed
US-20140371261-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-12-18 US disclosed
EP-2768499-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER Vanderbilt University (US) 2014-08-27 EP disclosed
WO-2013059245-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER VANDERBILT UNIVERSITY (US) 2013-04-25 WO 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 (7 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-20190350903-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER AKR1C3, AKR1C4, AKR1C1 KMT2A 3904/4885MEN1 2723/4885HTR1F 3842/4885
US-11738004-B2 Indomethacin analogs for the treatment of castrate-resistant prostate cancer AKR1C3, AKR1C4, AKR1C1 KMT2A 3904/4885MEN1 2723/4885HTR1F 3842/4885
US-20180271835-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER AKR1C3, AKR1C4, AKR1C1 KMT2A 3904/4885MEN1 2723/4885HTR1F 3842/4885
US-10398678-B2 Indomethacin analogs for the treatment of castrate-resistant prostate cancer AKR1C3, AKR1C4, AKR1C1 KMT2A 3904/4885MEN1 2723/4885HTR1F 3842/4885
US-20140371261-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER AKR1C3, AKR1C4, AKR1C1 KMT2A 3865/4885MEN1 2132/4885HTR1F 3739/4885
US-20210251960-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER AKR1C3, AKR1C4, AKR1C1 KMT2A 3904/4885MEN1 2723/4885HTR1F 3842/4885
US-20160303082-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER AKR1C3, AKR1C4, AKR1C1 KMT2A 3904/4885MEN1 2723/4885HTR1F 3842/4885

“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.