SCHEMBL7780583

SCHEMBL7780583

CCCCCCCCCc1ccc(-c2ccccc2)c(C(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.65
PPARA Q07869 2/20 0.61
FOLH1 Q04609 1/20 0.60
PPARG P37231 1/20 0.57
RARB P10826 9/20 0.56
RARA P10276 2/20 0.56
RARG P13631 1/20 0.56
PTPN11 Q06124 3/20 0.54
PLK1 P53350 1/20 0.53
LTB4R Q15722 1/20 0.53
LTB4R2 Q9NPC1 1/20 0.53
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
MTOR P42345 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL4599432 1.00 KAT8 (0.65) KAT8PPARAFOLH1PPARGRARB
SCHEMBL9766535 1.00 KAT8 (0.65) KAT8PPARAFOLH1PPARGRARB
Hydrochloric Acid SCHEMBL10395643 0.99 KAT8 (0.63) KAT8PPARAFOLH1PPARGRARB
Hydrochloric Acid SCHEMBL9766562 0.99 KAT8 (0.63) KAT8PPARAFOLH1PPARGRARB
SCHEMBL3737185 0.94 FOLH1 (0.63) KAT8PPARAFOLH1RARBPTPN11
SCHEMBL10395641 0.89 KAT8 (0.55) KAT8PPARAFOLH1PPARGRARB
SCHEMBL9766561 0.89 KAT8 (0.55) KAT8PPARAFOLH1PPARGRARB
SCHEMBL9665178 0.89 KAT8 (0.65) KAT8PPARAFOLH1PPARGRARB
SCHEMBL18038416 0.89 PPARA (0.65) KAT8PPARAPPARGRARBRARA
SCHEMBL3744651 0.88 FOLH1 (0.67) KAT8FOLH1PPARGLTB4RLTB4R2

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-0885876-B1 Swallow-tail-shaped liquid crystal compound MITSUBISHI GAS CHEMICAL CO (JP) 2001-09-05 EP disclosed
US-5976409-A ACHIRAL ANTI-FERROELECTRIC LIQUID CRYSTAL AND CAN BE CONVERTED TO AN OPTICALLY ACTIVE ANTI-FERROELECTRIC LIQUID CRYSTAL BY MIXING IT WITH AN OPTICALLY ACTIVE COMPOUND AS A CHIRAL DOPANT. MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1999-11-02 US disclosed
EP-0885876-A1 Swallow-tail-shaped liquid crystal compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-12-23 EP disclosed