SCHEMBL8440447

SCHEMBL8440447

O=C(O)c1cccc(-c2cscc2Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.54
RXRB P28702 2/20 0.54
KMO O15229 2/20 0.51
DDT P30046 1/20 0.46
FOLH1 Q04609 3/20 0.44
KEAP1 Q14145 1/20 0.44
FABP4 P15090 1/20 0.43
MAP4K4 O95819 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43

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
SCHEMBL8440446 0.82 CA12 (0.47)
SCHEMBL8443910 0.81 CYP2A6 (0.58) RXRARXRBKMODDTFOLH1
SCHEMBL6254589 0.78 RXRA (0.59) RXRARXRBKMODDTFOLH1
SCHEMBL2371293 0.78 KMO (0.61) RXRARXRBKMOFOLH1FABP4
SCHEMBL5841701 0.77 RXRA (0.57) RXRARXRBKMODDTFOLH1
SCHEMBL29386545 0.77 KMO (0.69) RXRARXRBKMODDTFOLH1
SCHEMBL16749639 0.77 KMO (0.69) RXRARXRBKMODDTFOLH1
SCHEMBL442436 0.75 SRD5A2 (0.62) RXRARXRBKMOMAP4K4
SCHEMBL2213546 0.75 KMO (0.73) RXRARXRBKMODDTFOLH1
SCHEMBL30259065 0.75 KMO (0.73) RXRARXRBKMODDTFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1070173-C Benzoylguanidine derivatives as medicaments FUJISAWA PHARMACEUTICAL CO (JP) 2001-08-29 CN disclosed
US-5968985-A INHIBITORS OF SODIUM ION/HYDROGEN ION EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed
CN-1158606-A Benzoylguanidine derivatives as medicaments FUJISAWA PHARMACEUTICAL CO (JP) 1997-09-03 CN disclosed
EP-0773927-A2 BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed
WO-1996004241-A2 BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 WO disclosed