SCHEMBL2000840

SCHEMBL2000840

Cc1c(C)c2ccc(N)cc2oc1=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.63
HSD17B3 P37058 1/20 0.62
HPGD P15428 4/20 0.61
KDM4E B2RXH2 3/20 0.61
ALDH1A1 P00352 3/20 0.61
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
GLA P06280 1/20 0.61
GAA P10253 1/20 0.61
CASP1 P29466 1/20 0.61
CASP7 P55210 1/20 0.61
CA9 Q16790 1/20 0.61
HSD17B10 Q99714 1/20 0.61
ACHE P22303 3/20 0.56
STS P08842 1/20 0.55
ALDH1A2 O94788 1/20 0.52
ALDH2 P05091 1/20 0.52
ALDH1B1 P30837 1/20 0.52
ALDH1A3 P47895 1/20 0.52
MAPT P10636 1/20 0.49

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
SCHEMBL2321714 0.86 KDM4E (0.54) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL17716551 0.86 SRC (0.57) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL9054643 0.86 HSD17B3 (0.67) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL11981284 0.83 SRC (0.74) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL22100633 0.83 SRC (0.58) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL28160722 0.83 KDM4E (0.51) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL6888225 0.82 SRC (0.53) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL22364114 0.82 SRC (0.68) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL8679670 0.82 SRC (0.53) SRCHSD17B3HPGDKDM4EALDH1A1
SCHEMBL180111 0.82 HPGD (0.50) SRCHSD17B3HPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108508129-A A kind of assay method of heparin class drug biological value 青岛海洋生物医药研究院股份有限公司 2018-09-07 CN disclosed
US-7960439-B1 Environmentally sensitive foldable oligomers IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2011-06-14 US disclosed
US-5830446-A UVITEX OB OR TINOPAL SFP GENERAL ELECTRIC COMPANY (US) 1998-11-03 US disclosed
EP-0151884-B1 LIQUID DETERGENT COMPOSITIONS Albright & Wilson Limited (GB) 1990-04-18 EP disclosed
US-4812532-A GLASS OR SILICA GEL SUPPORT, ANALYZING AMINES BIO-AFFINITY SYSTEMS, INC. (US) 1989-03-14 US disclosed
US-4051062-A 7-Amino coumarin dyes for flashlamp-pumped dye lasers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1977-09-27 US disclosed