SCHEMBL8399428

SCHEMBL8399428

Fc1ccc2nc(CNc3ccc(Cl)cc3)sc2c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP2D6 P10635 1/20 0.38
HPGD P15428 1/20 0.38
GFER P55789 1/20 0.38
NPC1 O15118 2/20 0.36
TP53 P04637 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
TRPM5 Q9NZQ8 1/20 0.36
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNE1 P24864 1/20 0.35

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
SCHEMBL8397890 0.90 RAB9A (0.37) ALDH1A1NPC1TP53RAB9ASMN1; SMN2
SCHEMBL8396660 0.88 MEN1 (0.36) MEN1KMT2AALDH1A1GFERNPC1
SCHEMBL8399195 0.88 MAPT (0.39) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL8399066 0.87 CYP1A2 (0.35) MEN1KMT2ACYP1A2CYP2C19ALDH1A1
SCHEMBL8398930 0.87 HDAC6 (0.48) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL8395544 0.84 GAA (0.43) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8400483 0.81 AKR1B1 (0.44) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL8395540 0.80 LDHA (0.31) MEN1KMT2ACYP1A2HPGDTP53
SCHEMBL8399268 0.80 SMN1; SMN2 (0.37) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL8399102 0.80 MEN1 (0.36) MEN1KMT2AHPGDLMNAMAPT

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
EP-0647636-B1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF SENJU PHARMA CO (JP) 1999-06-09 EP disclosed
US-5532257-A ENZYME INHIBITOR SENJU PHARMACEUTICAL CO., LTD (JP) 1996-07-02 US disclosed
EP-0647636-A1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Senju Pharmaceutical Co., Ltd. (JP) 1995-04-12 EP disclosed