SCHEMBL7985481

SCHEMBL7985481

CC(=O)N(c1ccccc1)c1cc(C(F)(F)F)ccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLQ O75417 5/20 0.41
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
KMO O15229 1/20 0.39
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 2/20 0.37
BACE1 P56817 1/20 0.37
GLA P06280 1/20 0.37
TACR1 P25103 1/20 0.37
ALDH1A1 P00352 3/20 0.37
CNR2 P34972 2/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RIOK2 Q9BVS4 1/20 0.37
SORT1 Q99523 1/20 0.37

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
SCHEMBL57464 0.89 POLQ (0.40) POLQMEN1KMT2AKMONOS3
SCHEMBL7982504 0.81 TSHR (0.42) MEN1TSHRKMT2AHTTSMN1; SMN2
SCHEMBL7978950 0.81 POLQ (0.47) POLQMEN1KMT2AMAPTHTT
SCHEMBL30285546 0.81 TSHR (0.42) MEN1TSHRKMT2AKMONOS3
SCHEMBL26186399 0.81 TSHR (0.42) MEN1TSHRKMT2AKMONOS3
SCHEMBL26186673 0.80 MAPT (0.39) MEN1TSHRKMT2AKMOMAPT
SCHEMBL7982464 0.80 MEN1 (0.47) MEN1TSHRKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7985479 0.79 POLQ (0.47) POLQKMT2AMAPTHTTCNR2
SCHEMBL24173416 0.79 P2RX4 (0.41) MEN1TSHRKMT2AALDH1A1KDM4E
SCHEMBL26186404 0.78 OPRD1 (0.48) MEN1TSHRKMT2AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
CN-1252068-A 3-piperidyl-4-oxoquinazoline derivatives and pharmaceutical compositions containing the same JAPAN TOBACCO INC (JP) 2000-05-03 CN disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed