SCHEMBL8388149

SCHEMBL8388149

CCCCCCCCCCCCCCCCCCc1ccc(C(C)=O)c(Br)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.57
KAT8 Q9H7Z6 2/20 0.54
PPARG P37231 1/20 0.54
THRA P10827 2/20 0.51
THRB P10828 2/20 0.51
RARB P10826 4/20 0.49
RARA P10276 1/20 0.49
RARG P13631 1/20 0.49
ALDH1A1 P00352 2/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
SHBG P04278 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL26000402 1.00 PPARA (0.57) PPARAKAT8PPARGTHRATHRB
SCHEMBL5696490 0.94 PPARA (0.49) PPARAKAT8PPARGTHRATHRB
SCHEMBL20504234 0.88 PPARA (0.70) PPARAKAT8PPARGRARBRARA
SCHEMBL5696462 0.87 CNR1 (0.43) PPARAPPARGTHRB
SCHEMBL27881911 0.86 PPARA (0.56) PPARAKAT8PPARGTHRATHRB
SCHEMBL11871709 0.86 PPARA (0.68) PPARAKAT8PPARGRARBRARA
SCHEMBL7139165 0.84 PPARA (0.54) PPARAKAT8PPARGTHRATHRB
SCHEMBL20503256 0.84 PPARA (0.57) PPARAKAT8PPARGTHRATHRB
SCHEMBL9767995 0.83 PPARA (0.77) PPARAKAT8PPARGRARBRARA
SCHEMBL10586282 0.83 PPARA (0.77) PPARAKAT8PPARGRARBRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0803083-B1 IMAGE-RECORDING MATERIALS POLAROID CORP (US) 1999-04-21 EP disclosed
EP-0803083-A1 IMAGE-RECORDING MATERIALS POLAROID CORPORATION (US) 1997-10-29 EP disclosed
US-5674986-A FOR HEAT-DEVELOPABLE PHOTOSENSITIVE IMAGE-RECORDING MATERIALS POLAROID CORPORATION (US) 1997-10-07 US disclosed
WO-1997018497-A1 IMAGE-RECORDING MATERIALS POLAROID CORPORATION (US) 1997-05-22 WO disclosed
US-5569574-A CONTAINING CYCLIC 1,3-SULFUR-OXYGEN MOIETY; DIFFUSION TRANSFER PROCESSES POLAROID CORPORATION (US) 1996-10-29 US disclosed