SCHEMBL5568183

SCHEMBL5568183

O=C(O)c1ccc(C23CC4CC(c5ccccc5)(C2)CC(c2ccc(C(=O)O)cc2)(C4)C3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.44
GRIN3B O60391 2/20 0.44
GRIN1 Q05586 2/20 0.44
GRIN2A Q12879 2/20 0.44
GRIN2B Q13224 2/20 0.44
GRIN2C Q14957 2/20 0.44
GRIN3A Q8TCU5 2/20 0.44
TSHR P16473 2/20 0.43
DAO P14920 1/20 0.43
NAPRT Q6XQN6 1/20 0.43
PGR P06401 2/20 0.43
HSD11B1 P28845 2/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
SRD5A2 P31213 1/20 0.42
TP53 P04637 1/20 0.41
ALDH1A1 P00352 1/20 0.40
RARA P10276 1/20 0.40
RARB P10826 1/20 0.40
RARG P13631 1/20 0.40

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
SCHEMBL5084601 0.95 TSHR (0.46) TSHRPGRSRD5A2TP53ALDH1A1
SCHEMBL25309350 0.87 TSHR (0.50) TSHRSRD5A2TP53ALDH1A1RARA
SCHEMBL5081784 0.87 TSHR (0.52) TSHRDAONAPRTCES2CES1
SCHEMBL5568792 0.85 EPHX2 (0.42) TSHRPGRTP53RARBRARG
SCHEMBL2745792 0.84 PGR (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6939188 0.83 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5481142 0.83 HIF1A (0.47) GRIN2BTSHRPGRALDH1A1
SCHEMBL5141270 0.83 HIF1A (0.47) GRIN2BTSHRPGRALDH1A1
SCHEMBL2746653 0.82 PGR (0.40) PGRHSD11B1RARARARBRARG
SCHEMBL5084654 0.81 TSHR (0.57) TSHRDAONAPRTCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070078256-A1 Prepolymers, prepolymer compositions, high-molecular-weight polymers with pore structure, and dielectric films DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-04-05 US disclosed
EP-1683822-A1 PREPOLYMER, PREPOLYMER COMPOSITION, HIGH MOLECULAR WEIGHT POLYMER HAVING STRUCTURE CONTAINING HOLE AND ELECTRICALLY INSULATING FILM Daicel Chemical Industries, Ltd. (JP) 2006-07-26 EP disclosed