SCHEMBL7488649

SCHEMBL7488649

COc1ccc(C2NCCc3c2[nH]c2ccccc32)cc1F

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 10/20 0.72
KMT2A Q03164 2/20 0.70
MEN1 O00255 1/20 0.70
RAD52 P43351 1/20 0.69
MAPT P10636 1/20 0.68
MAPK1 P28482 1/20 0.68
OXTR P30559 1/20 0.68
AVPR1A P37288 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
HTR7 P34969 2/20 0.67
EGFR P00533 7/20 0.66
HTR2A P28223 2/20 0.65
HTR2C P28335 2/20 0.65
HTR2B P41595 2/20 0.65
ERBB2 P04626 1/20 0.63
ERBB4 Q15303 1/20 0.63
CARM1 Q86X55 1/20 0.63
SLC2A1 P11166 1/20 0.61
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60

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
SCHEMBL6407779 0.90 KMT2A (0.82) PRMT5KMT2AMEN1RAD52MAPT
SCHEMBL7489301 0.86 HTR7 (0.68) PRMT5KMT2AMEN1RAD52MAPT
SCHEMBL8320590 0.85 PRMT5 (0.81) PRMT5KMT2AMEN1RAD52MAPT
SCHEMBL6779743 0.82 KMT2A (0.68) PRMT5KMT2AMEN1RAD52MAPT
SCHEMBL30274356 0.82 HTR7 (0.70) PRMT5HTR7EGFRHTR2AHTR2C
SCHEMBL538174 0.81 HTR7 (0.76) PRMT5KMT2AMEN1RAD52MAPT
SCHEMBL6782129 0.80 HTR7 (0.82) PRMT5KMT2AMEN1RAD52MAPT
SCHEMBL6088731 0.79 HTR7 (0.78) PRMT5KMT2ARAD52MAPTMAPK1
SCHEMBL997957 0.78 HTR7 (0.73) PRMT5HTR7EGFRHTR2AHTR2C
SCHEMBL2725785 0.78 HTR2C (0.73) PRMT5KMT2AMEN1RAD52MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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