SCHEMBL11442734

SCHEMBL11442734

O=C(O)Cc1c(Cl)cccc1Sc1cccc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.53
▸ SLC6A9 P48067 10/20 0.46
▸ POLB P06746 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ AGBL2 Q5U5Z8 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PRKAG1 P54619 1/20 0.38
▸ PRKAA2 P54646 1/20 0.38
▸ PRKAB1 Q9Y478 1/20 0.38
▸ EPHX1 P07099 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
SCHEMBL11427396 0.86 AKR1B1 (0.56) AKR1B1SLC6A9POLBKDM4EAGBL2
SCHEMBL30733478 0.86 AKR1B1 (0.62) AKR1B1POLBKDM4ELMNAGAA
SCHEMBL11551886 0.86 AKR1B1 (0.62) AKR1B1POLBKDM4ELMNAGAA
SCHEMBL11759778 0.78 SLC6A9 (0.48) SLC6A9AGBL2CYP2C9HPGDCYP2C19
SCHEMBL11756825 0.77 AGBL2 (0.55) SLC6A9AGBL2CYP2C9HPGDCYP2C19
SCHEMBL11552428 0.77 AKR1B1 (0.51) AKR1B1POLBKDM4ELMNAGAA
SCHEMBL4328724 0.75 SLC6A9 (0.43) SLC6A9POLBKDM4ELMNAHPGD
SCHEMBL11430842 0.75 MMP2 (0.63) AKR1B1SLC6A9POLBKDM4ELMNA
SCHEMBL10712007 0.73 AGBL2 (0.44) SLC6A9KDM4EAGBL2CYP2C9HPGD
SCHEMBL11554657 0.73 AKR1B1 (0.49) AKR1B1SLC6A9POLBKDM4ELMNA

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-4228284-A ANTIINFLAMMATORY AGENTS Nippon Chemiphar Company, Limited (JP) 1980-10-14 — — US disclosed
US-4166127-A ANTIINFLAMMATORY AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1979-08-28 — — US disclosed
US-4101667-A ANTIINFLAMMATORY AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1978-07-18 — — US disclosed
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