SCHEMBL11005693

SCHEMBL11005693

CSc1ccc2c(c1)C(C(=O)O)CCO2

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 7/20 0.46
HCRTR2 O43614 1/20 0.42
TSHR P16473 2/20 0.42
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL2792594 0.86 PTGDR2 (0.39) PTGDR2
SCHEMBL5162304 0.86 PTGDR2 (0.41) PTGDR2
SCHEMBL11002739 0.85 PTGDR2 (0.40) PTGDR2
SCHEMBL11003580 0.79 PTGDR2 (0.44) PTGDR2
SCHEMBL1846438 0.78 PTGDR2 (0.45) PTGDR2
SCHEMBL1846189 0.78 MAP3K14 (0.50) PTGDR2
SCHEMBL1843412 0.78 ADRA2A (0.46) PTGDR2HCRTR2MAPT
SCHEMBL1845395 0.77 PTGDR2 (0.49) PTGDR2
SCHEMBL11001528 0.75 PTGDR2 (0.41) PTGDR2
SCHEMBL1570198 0.74 PTGDR2 (0.43) PTGDR2HCRTR2

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
US-4530919-A A 1,2,3,4-tetrahydronaphthalene carboxylic acid PFIZER INC. (US) 1985-07-23 US disclosed
US-4374148-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1983-02-15 US disclosed
US-4305955-A ORAL HYPOGLYCEMIC AGENTS, CHROMAN-4-CARBOXYLIC ACID OR THIOCHROMAN-4-CARBOXYLIC ACID PFIZER INC. (US) 1981-12-15 US disclosed