SCHEMBL7414202

SCHEMBL7414202

CN(C)C(=O)C1CN(c2ccccc2)C(=O)c2c1c1cc(F)ccc1n2C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
HCRTR1 O43613 1/20 0.37
KMT2A Q03164 1/20 0.37
SRC P12931 1/20 0.36
PER2 O15055 3/20 0.36
CRY2 Q49AN0 2/20 0.36
PTGDR2 Q9Y5Y4 3/20 0.35
WDR5 P61964 1/20 0.35
ATM Q13315 1/20 0.34
HTR6 P50406 1/20 0.33

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
SCHEMBL7411910 0.87 CYP2C19 (0.37) MEN1KMT2ASRCWDR5ATM
SCHEMBL7414387 0.83 AKR1B1 (0.41) MEN1KMT2APTGDR2
SCHEMBL7412002 0.73 AKR1B1 (0.43) MEN1KMT2ASRCPTGDR2WDR5
SCHEMBL7415419 0.65 KDM4E (0.41)
SCHEMBL7413021 0.62 KDM4E (0.45) MEN1KMT2ASRC
SCHEMBL1120381 0.60 AKR1B1 (0.66) PER2CRY2PTGDR2
SCHEMBL12848451 0.60 FPR2 (0.44) MEN1KMT2A
SCHEMBL9734334 0.59 NPC1 (0.42) MEN1KMT2A
SCHEMBL31530864 0.58 NOTUM (0.45) MEN1KMT2A
SCHEMBL7408771 0.58 KDM4E (0.52) MEN1KMT2ASRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934319-B1 1H-PYRIDO[3,4-b]INDOLE-4-CARBOXAMIDE DERIVATIVES, PREPARATION AND APPLICATION THEREOF IN THERAPEUTICS SANOFI SYNTHELABO (FR) 2002-06-05 EP disclosed
US-6075021-A 1H-pyrido[3,4-b]indole-4-carboxamide derivatives, preparation and application thereof in therapeutics SYNTHELABO (FR) 2000-06-13 US disclosed