SCHEMBL9409756

SCHEMBL9409756

Cc1cc(-c2ccc(O)cc2)no1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.53
HSD17B2 P37059 1/20 0.53
RAB9A P51151 8/20 0.49
NPC1 O15118 8/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 4/20 0.44
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
MAPT P10636 2/20 0.42
HSD17B10 Q99714 2/20 0.42
PKM P14618 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HPGD P15428 2/20 0.42
POLB P06746 2/20 0.42

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
SCHEMBL12112412 0.83 RAB9A (0.66) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL4588205 0.82 RAB9A (0.50) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL14117652 0.80 ACHE (0.52) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL27425755 0.80 RAB9A (0.61) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL2301990 0.80 RAB9A (0.57) RAB9ANPC1KDM4EMAPTSMN1; SMN2
SCHEMBL562246 0.80 RAB9A (0.53) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL23291889 0.79 NOTUM (0.47) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL354043 0.79 RAB9A (0.61) RAB9ANPC1KDM4EALDH1A1CASP3
SCHEMBL11961411 0.78 ABCB1 (0.53) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL21121348 0.78 NPC1 (0.73) HSD17B1HSD17B2RAB9ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2694472-B1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2020-03-11 EP disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
EP-2694472-A2 SULFONAMIDE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2014-02-12 EP disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed
WO-2012137982-A9 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-14 WO disclosed
WO-2012137982-A2 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-11 WO disclosed
EP-0577218-A1 Heterocyclyl-phenoxyalkyl-piperidinylpyridazines as antiviral agents STERLING WINTHROP INC. (US) 1994-01-05 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF GRIN2A, GRIN2B, SLC1A2 HSD17B1 825/4885HSD17B2 801/4885RAB9A 3305/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.