SCHEMBL8086404

SCHEMBL8086404

CCC(C)Oc1cc(OC(C)CC)cc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.49
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.42
GCK P35557 6/20 0.41
MAPT P10636 2/20 0.40
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38

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
SCHEMBL14811996 0.93 RXRA (0.46) PLA2G2AGCKRXRA
SCHEMBL12858604 0.87 GCK (0.53) PLA2G2AKMT2AMEN1GCK
SCHEMBL8081508 0.86 PLA2G2A (0.50) PLA2G2AKMT2AMEN1GCK
SCHEMBL931250 0.84 KMT2A (0.59) KMT2ARXRARXRB
SCHEMBL1426871 0.84 MEN1 (0.71) KMT2AMEN1GCKRXRARXRB
SCHEMBL1262402 0.84 S1PR2 (0.47) KMT2AMEN1GCK
SCHEMBL1262405 0.84 S1PR2 (0.47) KMT2AMEN1GCK
SCHEMBL1107734 0.82 GCK (0.57) PLA2G2AGCKRARARARB
SCHEMBL17060015 0.82 PLA2G2A (0.46) PLA2G2AKMT2AMEN1GCKRXRA
SCHEMBL4684533 0.81 KMT2A (0.67) KMT2AMAPTRARBRXRARXRB

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-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed