SCHEMBL8419258

SCHEMBL8419258

Oc1c(Cl)cc(Oc2cc(Cl)cc(Cl)c2)c(O)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.53
STK39 Q9UEW8 5/20 0.43
TSHR P16473 5/20 0.43
HSD17B10 Q99714 5/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP3A4 P08684 2/20 0.43
RECQL P46063 2/20 0.43
HPGD P15428 4/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 2/20 0.35
TTR P02766 2/20 0.35
CASP1 P29466 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
NR1I2 O75469 1/20 0.35
SLC22A3 O75751 1/20 0.35
EGFR P00533 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL30168074 0.70 AKR1B1 (1.00) AKR1B1TSHRHSD17B10ALDH1A1CYP3A4
SCHEMBL4575982 0.70 AKR1B1 (1.00) AKR1B1TSHRHSD17B10ALDH1A1CYP3A4
SCHEMBL68191 0.68 HSD17B10 (0.77) AKR1B1TSHRHSD17B10ALDH1A1CYP3A4
SCHEMBL10706723 0.68 TSHR (0.57) TSHRALDH1A1CYP3A4KMT2AMAPT
SCHEMBL29542318 0.68 AKR1B1 (0.47) AKR1B1STK39TSHRHSD17B10ALDH1A1
SCHEMBL435162 0.68 AKR1B1 (0.68) AKR1B1STK39TSHRHSD17B10ALDH1A1
SCHEMBL4586762 0.67 TTR (0.63) STK39TSHRHSD17B10ALDH1A1CYP3A4
SCHEMBL11663615 0.67 CA1 (0.43) STK39TSHRALDH1A1HPGDTTR
SCHEMBL272067 0.67 HSD17B10 (0.55) AKR1B1STK39TSHRHSD17B10ALDH1A1
SCHEMBL11222220 0.66 HSP90AA1 (0.52) STK39TSHRHSD17B10ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0379058-B1 Vinyl ester resins containing mesogenic/rigid rodlike moieties DOW CHEMICAL CO (US) 1999-09-29 EP claimed
EP-0379058-B1 Vinyl ester resins containing mesogenic/rigid rodlike moieties DOW CHEMICAL CO (US) 1999-09-29 EP disclosed
US-5424393-A Curing into liquid crystals THE DOW CHEMICAL COMPANY (US) 1995-06-13 US disclosed
US-5248740-A Thioepoxides, liquid crystal polymers THE DOW CHEMICAL COMPANY (US) 1993-09-28 US disclosed