SCHEMBL8992922

SCHEMBL8992922

Cc1cccc(Cc2ccc(-c3cnn4c(O)ncnc34)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.43
LTA4H P09960 1/20 0.40
KDR P35968 4/20 0.40
FYN P06241 4/20 0.39
BRS3 P32247 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
PLK4 O00444 1/20 0.37
AURKA O14965 1/20 0.37
DYRK3 O43781 1/20 0.37
ROCK2 O75116 1/20 0.37
MAP4K4 O95819 1/20 0.37
ABL1 P00519 1/20 0.37
EGFR P00533 1/20 0.37
NTRK1 P04629 1/20 0.37
CDK1 P06493 1/20 0.37
FES P07332 1/20 0.37
CSF1R P07333 1/20 0.37
LYN P07948 1/20 0.37
RET P07949 1/20 0.37
KIT P10721 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
SCHEMBL8992965 0.88 GPR119 (0.41) GPR119KDRHCAR2POLBALDH1A1
SCHEMBL8992904 0.87 GPR119 (0.39) GPR119KDRFYNHCAR2EGFR
SCHEMBL8992955 0.87 NPC1 (0.43) GPR119FYNALDH1A1HPGDMEN1
SCHEMBL8993403 0.86 RAB9A (0.44) GPR119LTA4HFYNBRS3SRC
SCHEMBL8992950 0.86 LTA4H (0.43) LTA4HFYNBRS3HCAR2ABL1
SCHEMBL8993247 0.84 GPR119 (0.49) GPR119LTA4HKDRFYNBRS3
SCHEMBL8993183 0.84 FYN (0.40) GPR119KDRFYNHCAR2EGFR
SCHEMBL9221803 0.83 ALDH1A1 (0.44) KDRSRCPOLBALDH1A1HPGD
SCHEMBL8993290 0.81 GPR119 (0.41) GPR119LTA4HBRS3POLBALDH1A1
SCHEMBL8993213 0.81 RAB9A (0.46) GPR119KDRPOLBALDH1A1HPGD

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-5516777-A PROSTATE CANCER THERAPY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-05-14 US disclosed
US-5409928-A Prostate diseases, alopecia OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0594149-A2 Condensed pyrazole derivatives, method of manufacturing the same, and androgen inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed