SCHEMBL9355183

SCHEMBL9355183

O=C(O)CC(C(=O)O)=C(Cc1ccccc1Cl)Cc1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTBP2 P56545 1/20 0.53
▸ CXCL8 P10145 3/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ GFER P55789 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ TTR P02766 2/20 0.45
▸ AKR1B10 O60218 1/20 0.45
▸ UGT1A9 O60656 1/20 0.45
▸ TRPA1 O75762 1/20 0.45
▸ ABCB11 O95342 1/20 0.45
▸ MT-CO2 P00403 1/20 0.45
▸ ALB P02768 1/20 0.45
▸ UGT1A6 P19224 1/20 0.45
▸ UGT1A1 P22309 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ CXCR1 P25024 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ AGTR2 P50052 1/20 0.45

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
SCHEMBL9064566 0.82 CTBP2 (0.62) CTBP2CXCL8RAB9AGFERSMN1; SMN2
SCHEMBL9065173 0.82 CTBP2 (0.62) CTBP2CXCL8RAB9AGFERSMN1; SMN2
SCHEMBL9064571 0.82 CTBP2 (0.62) CTBP2CXCL8RAB9AGFERSMN1; SMN2
SCHEMBL9355491 0.81 ALDH1A1 (0.46) ALDH1A1
SCHEMBL9355175 0.80 CA12 (0.41) RAB9ANPC1ALDH1A1KMT2AAKR1B1
SCHEMBL8209138 0.79 CTBP2 (0.54) CTBP2CXCL8RAB9AGFERSMN1; SMN2
SCHEMBL194831 0.78 CXCL8 (0.65) CTBP2CXCL8RAB9AGFERSMN1; SMN2
SCHEMBL29933245 0.78 CXCL8 (0.65) CTBP2CXCL8RAB9AGFERSMN1; SMN2
SCHEMBL9354985 0.77 AKR1B1 (0.56) CTBP2PTGS1L3MBTL1ALDH1A1KMT2A
SCHEMBL10660814 0.76 POLQ (0.50) PTGS2ALDH1A1KMT2AKDM4E

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-0242618-B1 Transparent optical article and process for preparing same NIPPON OILS & FATS CO LTD (JP) 1994-11-02 — — EP claimed
JP-1045412-A — — None — — JP disclosed
JP-1189601-A — — None — — JP disclosed
JP-H01189601-A SYNTHETIC RESIN LENS SEIKO EPSON CORP 1989-07-28 — — JP disclosed
JP-S6445412-A COMPOSITION FOR LENS MADE OF SYNTHETIC POLYMER SEIKO EPSON CORP 1989-02-17 — — JP disclosed
Send feedback