SCHEMBL6964905

SCHEMBL6964905

O=C1C(c2ccccc2)CN1c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 1/20 0.50
MAPT P10636 3/20 0.46
ROCK2 O75116 2/20 0.42
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40
GRM5 P41594 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CYP19A1 P11511 1/20 0.39
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
ALDH1A1 P00352 2/20 0.39

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
SCHEMBL225262 0.88 KMT2A (0.47) FADS1MAPTROCK2TSHRALOX15
Water SCHEMBL2910884 0.86 KMT2A (0.45) FADS1MAPTROCK2TSHRALOX15
SCHEMBL5969405 0.74 KMT2A (0.59) MAPTTSHRKMT2AMEN1RECQL
SCHEMBL8495437 0.73 ATM (0.51) MAPTKMT2AMEN1CYP19A1CTSG
SCHEMBL8495439 0.73 ATM (0.51) MAPTKMT2AMEN1CYP19A1CTSG
SCHEMBL29187460 0.72 ALOX15 (0.45) FADS1MAPTTSHRALOX15KMT2A
SCHEMBL29187457 0.72 ALOX15 (0.45) FADS1MAPTTSHRALOX15KMT2A
SCHEMBL4721528 0.70 ROCK2 (0.62) ROCK2TSHRKMT2AMEN1
SCHEMBL8494181 0.70 POLB (0.50) KMT2AMEN1ALDH1A1
SCHEMBL2800406 0.70 POLB (0.50) KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1362855-A1 BETA-LACTAM COMPOUNDS, PROCESS FOR REPODUCING THE SAME AND SERUM CHOLESTEROL-LOWERING AGENTS CONTAINING THE SAME Kotobuki Pharmaceutical Co., Ltd. (JP) 2003-11-19 EP disclosed