SCHEMBL27438656

SCHEMBL27438656

C=C(C)C(=O)Oc1ccc(CCC)c(O)c1O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.47
ELANE P08246 3/20 0.37
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
CTSG P08311 1/20 0.35
THRB P10828 2/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL5161561 0.86 ALOX5 (0.48) PRKCIELANEGABRA1GABRB2THRB
SCHEMBL15495756 0.80 PTPN1 (0.40) PRKCIGABRA1GABRB2
SCHEMBL6156027 0.79 PRKCI (0.49) PRKCIELANECTSGTHRBTSHR
SCHEMBL2318328 0.79 CREBBP (0.41) ELANETHRBTSHR
SCHEMBL2154197 0.78 GABRA1 (0.35) PRKCIELANEGABRA1GABRB2THRB
SCHEMBL31572664 0.78 THRA (0.51) ELANETHRB
SCHEMBL4596507 0.78 THRA (0.51) ELANETHRB
SCHEMBL11709701 0.77 MTNR1A (0.35) PRKCIELANETHRBTSHR
SCHEMBL28395628 0.76 ELANE (0.41) ELANETSHR
SCHEMBL11709262 0.76 TSHR (0.39) ELANETHRBTSHR

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
CN-1124292-C Polymer films with controlled viscosity response to temperature and shear DU PONT (US) 2003-10-15 CN disclosed
CN-1292804-A Polymeric films having controlled viscosity response to temp. and shear DU PONT (US) 2001-04-25 CN disclosed