SCHEMBL8440901

SCHEMBL8440901

COC(=O)c1cccc(-c2cc(Cl)sc2Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
CYP2A6 P11509 1/20 0.47
ERN1 O75460 1/20 0.46
AXL P30530 1/20 0.45
POLB P06746 1/20 0.44
ASH1L Q9NR48 1/20 0.44
IL2 P60568 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MAPT P10636 2/20 0.44
PLAU P00749 2/20 0.44
LOXL2 Q9Y4K0 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
SCHEMBL8444315 0.85 CA12 (0.42) CNR1CA12CA1CA2CA9
SCHEMBL8444332 0.80 CA12 (0.47) CNR1CA12CA1CA2CA9
SCHEMBL8441395 0.80 DAO (0.40) CA12CA1CA2CA9CYP2A6
SCHEMBL8817610 0.80 CA12 (0.53) CNR1CA12CA1CA2CA9
SCHEMBL16749656 0.80 CA12 (0.58) CA12CA1CA2CA9ERN1
SCHEMBL8443409 0.78 CNR1 (0.61) CNR1CA12CA1CA2CA9
SCHEMBL7844717 0.78 KAT6A (0.53) CA12CA1CA2CA9ERN1
SCHEMBL67941 0.78 CA12 (0.68) CA12CA1CA2CA9ERN1
SCHEMBL8440446 0.77 CA12 (0.47) CNR1CA12CA1CA2CA9
SCHEMBL8443917 0.77 KMT2A (0.52) CA12CA1CA2CA9ERN1

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