SCHEMBL8398149

SCHEMBL8398149

C=C1CC(CCC)C(=O)O1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.33
KAT2A Q92830 3/20 0.32
CYP1A2 P05177 1/20 0.30

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
SCHEMBL8394016 0.89 ALDH1A1 (0.40) ALDH1A1TSHRKMT2ACYP1A2
SCHEMBL8398070 0.87 ALDH1A1 (0.42) ALDH1A1TSHRCYP1A2
SCHEMBL10416344 0.85 ALDH1A1 (0.44) ALDH1A1TSHRCYP1A2
SCHEMBL8398214 0.85 ALDH1A1 (0.44) ALDH1A1TSHRCYP1A2
SCHEMBL3866971 0.85 ALDH1A1 (0.44) ALDH1A1TSHRCYP1A2
SCHEMBL8394085 0.83
SCHEMBL29109668 0.79 ALDH1A1 (0.51) ALDH1A1TSHRKMT2ACYP1A2
SCHEMBL331857 0.79 ALDH1A1 (0.51) ALDH1A1TSHRKMT2ACYP1A2
SCHEMBL18022414 0.78 ALDH1A1 (0.48) ALDH1A1TSHR
SCHEMBL12987997 0.78 ALDH1A1 (0.50) ALDH1A1TSHRKMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0722960-B1 Copolymers for preparing cast glass, or molding materials for preparing heat stable shaped articles AGOMER GES MIT BESCHRAENKTER H (DE) 1999-06-02 EP disclosed
US-5880235-A POLYMER PREPARED BY COPOLYMERIZING ALPHA-METHYLENE-GAMMA-BUTYROLACTONE AND VINYLICALLY UNSATURATED MONOMER AGOMER GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-03-09 US disclosed
EP-0722960-A2 Copolymers for preparing cast glass, or molding materials for preparing heat stable shaped articles Degussa Aktiengesellschaft (DE) 1996-07-24 EP disclosed