SCHEMBL3709723

SCHEMBL3709723

Cc1ccc(C2NCCc3c2[nH]c2ccccc32)cc1

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.78
CYP3A4 P08684 1/20 0.78
CYP2D6 P10635 1/20 0.78
CYP2C19 P33261 1/20 0.78
HTR2A P28223 9/20 0.68
HTR2C P28335 8/20 0.68
DRD2 P14416 1/20 0.62
PRMT5 O14744 3/20 0.60
EGFR P00533 2/20 0.60
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57

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
SCHEMBL274149 0.88 HTR7 (1.00) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL6089057 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL30274365 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL6088731 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL23875899 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL23875880 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL3713285 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL6786360 0.86 HTR7 (0.78) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL30274410 0.86 HTR7 (0.83) HTR7CYP3A4CYP2D6CYP2C19HTR2A
SCHEMBL10611032 0.85 HTR7 (0.72) HTR7CYP3A4CYP2D6CYP2C19HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850269-A Tetrahydro-beta-carboline compound and preparation method and application thereof 南京工业大学 2023-03-28 CN disclosed
US-20220202786-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORPORATION (US) 2022-06-30 US disclosed
US-20220202786-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORPORATION (US) 2022-06-30 US disclosed
US-11202775-B2 Methods for treatment of cancer MINERVA BIOTECHNOLOGIES CORPORATION (US) 2021-12-21 US disclosed
US-11202775-B2 Methods for treatment of cancer MINERVA BIOTECHNOLOGIES CORPORATION (US) 2021-12-21 US disclosed
EP-2214485-B1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORP (US) 2016-07-20 EP disclosed
EP-2214485-B1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORP (US) 2016-07-20 EP disclosed
EP-2214485-A1 METHODS FOR TREATMENT OF CANCER Minerva Biotechnologies Corp. (US) 2010-08-11 EP disclosed
WO-2009042815-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORP. (US) 2009-04-02 WO disclosed
WO-2009042815-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORP. (US) 2009-04-02 WO disclosed
US-20090069367-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORPORATION 2009-03-12 US disclosed
US-20090069367-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORPORATION 2009-03-12 US disclosed
US-20090069367-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORPORATION 2009-03-12 US disclosed
EP-0912567-B1 CARBOLINE DERIVATIVES ICOS CORP (US) 2002-04-10 EP disclosed
US-6306870-B1 PHOSPHODIESTERASE ENZYME INHIBITORS, CARDIOVASCULAR DISORDERS AND SEXUAL DISORDERS ICOS CORPORATION 2001-10-23 US disclosed
US-6117881-A POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE ICOS CORPORATION (US) 2000-09-12 US disclosed
US-6043252-A A POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE (CGMP-SPECIFIC PDE); TREATING CARDIOVASCULAR DISORDERS AND ERECTILE DYSFUNCTION ICOS CORPORATION (US) 2000-03-28 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 (3 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-20090069367-A1 METHODS FOR TREATMENT OF CANCER TP53, TOP2B, BRCA1 HTR7 3317/4885CYP3A4 860/4885CYP2D6 1833/4885
US-11202775-B2 Methods for treatment of cancer TP53, TOP2B, BRCA1 HTR7 3317/4885CYP3A4 860/4885CYP2D6 1833/4885
US-20220202786-A1 METHODS FOR TREATMENT OF CANCER TP53, TOP2B, BRCA1 HTR7 3317/4885CYP3A4 860/4885CYP2D6 1833/4885

“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.