SCHEMBL7658751

SCHEMBL7658751

CSc1ccc(CBr)cc1C#N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 1/20 0.36
MAOB P27338 6/20 0.35
KCNJ1 P48048 1/20 0.33
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 2/20 0.33
MAOA P21397 4/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
AR P10275 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
CYP2A6 P11509 1/20 0.31
SNCA P37840 1/20 0.30

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
SCHEMBL19254702 0.84 CYP2A6 (0.44) KMT2AALDH1A1MEN1POLBMAOB
SCHEMBL1606027 0.82 ALDH1A1 (0.39) KMT2AALDH1A1MEN1POLBMAOB
SCHEMBL25929324 0.81 CNR1 (0.38) KMT2AALDH1A1MEN1POLBMAOB
SCHEMBL6231117 0.78 HPGD (0.41) KMT2AALDH1A1MEN1POLBKCNJ1
SCHEMBL5066101 0.77 MAOB (0.49) ALDH1A1MAOBKDM4EMAOACYP1A2
SCHEMBL25929341 0.76 KCNJ1 (0.34) KMT2AALDH1A1MEN1POLBMAOB
SCHEMBL5637278 0.76 MAOB (0.42) KMT2AALDH1A1MEN1POLBMAOB
SCHEMBL7714887 0.76 TSHR (0.43) ALDH1A1POLBMAOBKDM4EMAPT
SCHEMBL20928861 0.75 CYP3A4 (0.40) ALDH1A1HPGDMAPTCYP1A2CYP3A4
SCHEMBL15716128 0.73 MAOB (0.39) ALDH1A1MAOBMAOACYP1A2CYP2D6

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-6384061-B1 HYDANTOIN COMPOUNDS REPRESENTED BY FORMULA (I) WHICH SHOWS AN INHIBITORY ACTIVITY AGAINST FARNESYL TRANSFERASE, AND THUS CAN BE USED AS AN ANTI-CANCER AGENT, OR PHARMACEUTICALLY ACCEPTABLE SALTS LG CHEMICAL LTD. (KR) 2002-05-07 US disclosed
EP-1000036-A1 HYDANTOIN DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE LG CHEMICAL LIMITED (KR) 2000-05-17 EP disclosed
WO-1999005117-A1 HYDANTOIN DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE LG CHEMICAL LTD. (KR) 1999-02-04 WO disclosed