SCHEMBL4024926

SCHEMBL4024926

COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.74
KMT2A Q03164 4/20 0.74
NPC1 O15118 1/20 0.74
RAB9A P51151 1/20 0.74
MAPT P10636 9/20 0.68
THRB P10828 2/20 0.68
KDM4E B2RXH2 6/20 0.67
LMNA P02545 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
ALDH1A1 P00352 3/20 0.67
TP53 P04637 2/20 0.67
CASP1 P29466 1/20 0.62
MAPK1 P28482 1/20 0.61
F2 P00734 1/20 0.60
POLB P06746 1/20 0.56
HPGD P15428 1/20 0.56
PARP1 P09874 1/20 0.56

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
SCHEMBL30523171 1.00 MEN1 (0.74) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL2485234 0.89 MAPT (0.61) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL6688391 0.88 MAPT (0.60) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL4780133 0.85 MEN1 (1.00) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL4258762 0.84 MAPT (0.68) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL14258614 0.83 KMT2A (0.63) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL29643236 0.82 MAPT (0.70) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL1586929 0.82 MAPT (0.70) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30523150 0.82 MEN1 (0.61) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL29059075 0.82 MEN1 (0.61) MEN1KMT2ANPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116396278-A Carbazole derivatives as dopamine D3 receptor selectivity modulators 北京大学 2023-07-07 CN disclosed
WO-2009103022-A1 DERIVATIVES OF SUBSTITUTED FUSED RING CYCLOINDOLES AND METHODS OF THEIR USE ITHERX PHARMACEUTICALS, INC. (US) 2009-08-20 WO disclosed
WO-2008021745-A2 HEPATITIS C VIRUS ENTRY INHIBITORS ITHERX PHARMACEUTICALS, INC. (US) 2008-02-21 WO disclosed
US-6713473-B1 6-CARBAMATE-1,2,3,4-TETRAHYDROCARBAZOLE DERIVATIVES; AFFINITY FOR NEUROPEPTIDE Y RECEPTORS MEIJI SEIKA KAISHA, LTD. (JP) 2004-03-30 US disclosed
EP-1184373-A1 TRICYCLIC COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 2002-03-06 EP disclosed