SCHEMBL5693337

SCHEMBL5693337

O=C(O)c1ccc(C=Cc2cc(Cl)c(O)c(Cl)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 4/20 0.57
PTPN2 P17706 2/20 0.47
PTPN1 P18031 2/20 0.47
PTPN6 P29350 2/20 0.47
ALDH1A1 P00352 1/20 0.47
FBP1 P09467 1/20 0.46
TSHR P16473 3/20 0.46
PIM1 P11309 1/20 0.46
RARA P10276 2/20 0.45
RARB P10826 2/20 0.45
RARG P13631 2/20 0.45
ALOX15 P16050 1/20 0.45
SRD5A2 P31213 1/20 0.44
CA2 P00918 1/20 0.44
ALOX5 P09917 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
MCL1 Q07820 1/20 0.43

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
SCHEMBL5693335 1.00 TTR (0.57) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL5692806 0.84 BACE1 (0.56) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL5692808 0.84 BACE1 (0.56) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL14328640 0.82 ALDH1A1 (0.60) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL6712340 0.81 AHR (0.61) TTRALDH1A1FBP1TSHRRARA
SCHEMBL6712336 0.81 AHR (0.61) TTRALDH1A1FBP1TSHRRARA
SCHEMBL2615887 0.80 ALDH1A1 (0.68) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL9681086 0.80 ALDH1A1 (0.68) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL9681088 0.80 ALDH1A1 (0.68) TTRPTPN2PTPN1PTPN6ALDH1A1
SCHEMBL69167 0.80 ALDH1A1 (0.68) TTRPTPN2PTPN1PTPN6ALDH1A1

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-0905164-B1 Liquid crystalline polyester compositions and their uses NIPPON MITSUBISHI OIL CORP (JP) 2006-05-03 EP disclosed
US-5989758-A EXHIBIT A LIQUID CRYSTALLINE PHASE AT TIME OF FUSION, WHICH CAN BE FIXED UPON COOLING BELOW THE LIQUID CRYSTALLINE TRANSITION TEMPERATURE; SPECIFIC MONOMERS 4,4'-STILBENEDIOLS, CATECHOLS, AND 4'-HYDROXY-4-STILBENECARBOXYLIC ACIDS NIPPON OIL COMPANY, LIMITED (JP) 1999-11-23 US disclosed
EP-0905164-A2 Liquid crystalline polyesters, their composition, and their uses NIPPON OIL CO., LTD. (JP) 1999-03-31 EP disclosed