SCHEMBL3227577

SCHEMBL3227577

[c]1ccc2[nH]c3[c]cccc3c2c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
GPR3 P46089 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL5030 0.80 ALDH1A1 (0.54) ALDH1A1GPR3HSD17B10
SCHEMBL28756926 0.79 ALDH1A1 (0.52) ALDH1A1GPR3HSD17B10
Ammonia Solution, Strong SCHEMBL29143440 0.79 ALDH1A1 (0.52) ALDH1A1GPR3HSD17B10
SCHEMBL28379563 0.79 ALDH1A1 (0.52) ALDH1A1GPR3HSD17B10
SCHEMBL26678217 0.79 ALDH1A1 (0.52) ALDH1A1GPR3HSD17B10
SCHEMBL28458247 0.79 ALDH1A1 (0.52) ALDH1A1GPR3HSD17B10
SCHEMBL27478305 0.78 ALDH1A1 (0.46) ALDH1A1GPR3HSD17B10
SCHEMBL852559 0.77 ALDH1A1 (0.39) ALDH1A1GPR3HSD17B10
SCHEMBL16669006 0.77 ALDH1A1 (0.33) ALDH1A1GPR3HSD17B10
Water SCHEMBL28255864 0.77 ALDH1A1 (0.50) ALDH1A1GPR3HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102427729-A Inhibitors of hepatitis c virus replication MERCK SHARP & DOHME 2012-04-25 CN claimed
US-7705528-B2 Aromatic monomer-and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-27 US claimed
JP-2007501230-A 2007-01-25 JP claimed
WO-2005016945-A1 AROMATIC MONOMER-AND CONJUGATED POLYMER-METAL COMPLEXES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-02-24 WO claimed
US-20050031900-A1 Aromatic monomer-and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-02-10 US claimed
WO-2005010081-A1 AROMATIC MONOMER-AND CONJUGATED POLYMER-METAL COMPLEXES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-02-03 WO claimed
US-20050014023-A1 Aromatic monomer- and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-20 US claimed
US-7803885-B2 Pentathienyl-fluorene copolymer DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-28 US disclosed
US-20070210302-A1 Pentathienyl-Fluorene Copolymer DOW GLOBAL TECHNOLOGIES LLC 2007-09-13 US disclosed
WO-2005092947-A1 PENTATHIENYL-FLUORENE COPOLYMER DOW GLOBAL TECHNOLOGIES INC. (US) 2005-10-06 WO disclosed
US-20050014023-A1 Aromatic monomer- and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-20 US disclosed