SCHEMBL7604979

SCHEMBL7604979

NC(O)c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.54
TAAR1 Q96RJ0 3/20 0.54
NFKB1 P19838 2/20 0.54
HTR3A P46098 1/20 0.54
TSHR P16473 1/20 0.54
ALOX15 P16050 4/20 0.52
KDM4E B2RXH2 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
APEX1 P27695 1/20 0.52
ESR1 P03372 7/20 0.50
ESR2 Q92731 6/20 0.50
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
CYP3A4 P08684 3/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
CA3 P07451 2/20 0.47
THPO P40225 2/20 0.47
BLM P54132 2/20 0.47

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
SCHEMBL17477275 0.79 ESR1 (0.52) HIF1ATAAR1NFKB1HTR3ATSHR
SCHEMBL17477274 0.79 ESR1 (0.52) HIF1ATAAR1NFKB1HTR3ATSHR
SCHEMBL3949187 0.79 ESR1 (0.52) HIF1ATAAR1NFKB1HTR3ATSHR
SCHEMBL8607150 0.79 ESR1 (0.52) HIF1ATAAR1NFKB1HTR3ATSHR
SCHEMBL926425 0.79 ESR1 (0.52) HIF1ATAAR1NFKB1HTR3ATSHR
SCHEMBL22184055 0.77 MAPT (0.47) HIF1ATSHRALOX15KDM4ETDP1
Bromide SCHEMBL10782996 0.77 ESR1 (0.50) HIF1ATAAR1NFKB1HTR3ATSHR
SCHEMBL10866227 0.77 ESR1 (0.50) HIF1ATAAR1NFKB1HTR3ATSHR
Hydrochloric Acid SCHEMBL30098210 0.77 ALOX15 (0.52) HIF1ATAAR1NFKB1HTR3ATSHR
Bis(4-Hydroxyphenyl)Methanol SCHEMBL3642317 0.75 CYP3A4 (0.62) HIF1ATAAR1NFKB1HTR3ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002504529-A 2002-02-12 JP claimed
EP-1060160-A2 DISUBSTITUTED LAVENDUSTIN A ANALOGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ANALOGS THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2000-12-20 EP claimed
WO-1999043636-A2 DISUBSTITUTED LAVENDUSTIN A ANALOGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ANALOGS THE UNITED STATES OF AMERICA AS REPRESENTED BY THESECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-09-02 WO claimed
WO-2023196556-A1 CANNABINOID RECEPTOR 1 ANTAGONISTS/INVERSE AGONISTS AND USES THEREOF CORBUS PHARMACEUTICALS, INC. (US) 2023-10-12 WO disclosed
WO-2021156289-A1 COMBINATION CONTAINING A DUOCARMYCIN DERIVATIVE-COMPRISING ANTIBODY-DRUG CONJUGATE AND THIOSULFATE BYONDIS B.V. (NL) 2021-08-12 WO disclosed
WO-2021110860-A1 REACTIVE CONJUGATES DEBIOPHARM RESEARCH & MANUFACTURING S.A. (CH) 2021-06-10 WO disclosed
CN-1045005-C Novel bisoxadiazolidine derivative YAMANOUCHI PHARMA CO LTD (JP) 1999-09-08 CN disclosed
CN-1122133-A Novel bis-oxadiazolidine derivatives YAMANOUCHI PHARMA CO LTD (JP) 1996-05-08 CN disclosed