SCHEMBL7810682

SCHEMBL7810682

Cc1csc(C(=O)Cl)c1C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.41
POLB P06746 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.35
GPR35 Q9HC97 2/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 1/20 0.32
F10 P00742 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
DAO P14920 2/20 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
SCHEMBL2722085 0.80 F10 (0.41) GSK3BPOLBTDP1L3MBTL1GAA
SCHEMBL3045573 0.80 GPR35 (0.44) GSK3BPOLBTDP1L3MBTL1KMT2A
SCHEMBL3836429 0.79 POLB (0.55) GSK3BPOLBTDP1L3MBTL1GAA
SCHEMBL15765015 0.79 POLB (0.41) GSK3BPOLBTDP1L3MBTL1GAA
SCHEMBL14463157 0.78 GSK3B (0.39) GSK3BPOLBTDP1L3MBTL1GPR35
Hydrochloric Acid SCHEMBL7810688 0.77 POLB (0.53) GSK3BPOLBTDP1L3MBTL1GAA
SCHEMBL27494475 0.77 GAA (0.42) GSK3BPOLBTDP1L3MBTL1GAA
SCHEMBL4504634 0.76 POLB (0.43) GSK3BPOLBTDP1L3MBTL1GAA
SCHEMBL167302 0.74 MAPT (0.51) POLBTDP1GAAKMT2AMAPT
SCHEMBL8572414 0.74 BAZ2B (0.46) GSK3BPOLBTDP1L3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0889891-B1 4-[(THIEN-2-YL)METHYL]IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO MCNEIL PHARM INC (US) 2001-06-06 EP disclosed
EP-0889891-A1 4-[(THIEN-2-YL)METHYL]IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO PHARMACEUTICAL CORPORATION (US) 1999-01-13 EP disclosed
WO-1997035857-A1 4-[(THIEN-2-YL)METHYL]IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO PHARMACEUTICAL CORPORATION (US) 1997-10-02 WO disclosed
US-5621113-A ALPHA 2 ADRENOCEPTOR AGONISTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-04-15 US disclosed