SCHEMBL8326385

SCHEMBL8326385

N[C@H](CCc1ccccc1)c1[c]ccc(F)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
ERAP1 Q9NZ08 4/20 0.36
ANPEP P15144 3/20 0.36
ERAP2 Q6P179 3/20 0.36
HTR2A P28223 2/20 0.34
CYP2A6 P11509 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
POLB P06746 1/20 0.32
MAOA P21397 1/20 0.32
METAP2 P50579 1/20 0.32
LAP3 P28838 3/20 0.32
BLM P54132 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL8324453 0.81 IDO1 (0.44) IDO1TDO2ERAP1ANPEPERAP2
SCHEMBL8327831 0.74 METAP2 (0.41) ERAP1ANPEPERAP2METAP2LAP3
SCHEMBL8330006 0.73 ERAP1 (0.39) IDO1TDO2ERAP1ANPEPERAP2
SCHEMBL8328483 0.73 ERAP1 (0.39) IDO1TDO2ERAP1ANPEPERAP2
SCHEMBL8321060 0.71 ERAP1 (0.37) IDO1TDO2ERAP1ANPEPERAP2
SCHEMBL8326680 0.71 ERAP1 (0.37) IDO1TDO2ERAP1ANPEPERAP2
SCHEMBL8325222 0.70 ERAP1 (0.36) IDO1TDO2ERAP1ANPEPERAP2
SCHEMBL5924988 0.65 ANPEP (0.50) ERAP1ANPEPERAP2HTR2ACYP2A6
SCHEMBL855071 0.65 ANPEP (0.50) ERAP1ANPEPERAP2HTR2ACYP2A6
SCHEMBL6432692 0.65 ANPEP (0.50) ERAP1ANPEPERAP2HTR2ACYP2A6

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-0948496-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE Amgen inc. (US) 1999-10-13 EP disclosed
WO-1998024780-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 WO disclosed