SCHEMBL11557937

SCHEMBL11557937

CCc1oc2c(OC)cccc2c1C(=O)c1ccc(Cl)c(S(=O)(=O)NC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TSHR P16473 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ACLY P53396 1/20 0.39
▸ CYP2C19 P33261 4/20 0.39
▸ SLC22A12 Q96S37 2/20 0.39
▸ FABP4 P15090 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ GSTO1 P78417 1/20 0.38
▸ GUSB P08236 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.37
▸ TTR P02766 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
SCHEMBL11556805 0.89 STAT3 (0.45) ALDH1A1KDM4ECYP2C19SLC22A12LMNA
SCHEMBL11554551 0.82 CYP2C19 (0.57) CYP2C9CYP3A4ALDH1A1TSHRCYP2C19
SCHEMBL1287495 0.76 CYP2C9 (0.60) CYP2C9ALDH1A1SMN1; SMN2CYP2C19SLC22A12
SCHEMBL11561612 0.71 RAB9A (0.59) ALDH1A1SMN1; SMN2KDM4EACLYKMT2A
SCHEMBL11553624 0.70 CYP2C19 (0.53) CYP2C9CYP2C19LMNAMAPTHTT
SCHEMBL11560887 0.70 CNR2 (0.53) SMN1; SMN2TSHRACLYCYP2C19KMT2A
SCHEMBL11556111 0.70 CYP2C19 (0.60) CYP2C9CYP3A4ALDH1A1TSHRCYP2C19
SCHEMBL1288046 0.69 CYP2C19 (0.63) CYP2C9CYP3A4ALDH1A1TSHRCYP2C19
SCHEMBL11550671 0.68 SLC22A12 (0.64) CYP2C9ALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL11550650 0.68 SLC22A12 (0.64) CYP2C9CYP3A4ALDH1A1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156732-A Certain pharmaceutical sulfamoylbenzoyl benzofurans, benzothiophenes, and indoles HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-29 — — US disclosed
EP-0000128-A1 Sulfamoylaryl ketones, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1979-01-10 — — EP disclosed
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