SCHEMBL29629486

SCHEMBL29629486

Clc1cc(Oc2cc(Cl)c(Cl)c(Cl)c2I)c(I)c(Cl)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.54
CYP3A4 P08684 3/20 0.41
HPGD P15428 4/20 0.33
HSD17B10 Q99714 4/20 0.33
TSHR P16473 3/20 0.33
ALDH1A1 P00352 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPK1 P28482 1/20 0.33
NR1I2 O75469 1/20 0.32
ADRA2A P08913 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
TACR2 P21452 1/20 0.32
DRD1 P21728 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADORA1 P30542 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL22118213 1.00 AKR1B1 (0.54) AKR1B1CYP3A4HPGDHSD17B10TSHR
SCHEMBL22138547 0.78 AKR1B1 (0.38) AKR1B1CYP3A4HPGDTSHRALDH1A1
SCHEMBL10715975 0.76 AKR1B1 (0.61) AKR1B1CYP3A4HPGDHSD17B10TSHR
SCHEMBL10873971 0.73 CYP3A4 (0.59) AKR1B1CYP3A4HPGDHSD17B10TSHR
SCHEMBL30168074 0.70 AKR1B1 (1.00) AKR1B1CYP3A4HPGDHSD17B10TSHR
SCHEMBL22118215 0.70 AKR1B1 (0.33) AKR1B1CYP3A4HPGDHSP90AA1MAPK1
SCHEMBL4575982 0.70 AKR1B1 (1.00) AKR1B1CYP3A4HPGDHSD17B10TSHR
SCHEMBL29629487 0.70 AKR1B1 (0.33) AKR1B1CYP3A4HPGDHSP90AA1MAPK1
SCHEMBL22118203 0.69 AKR1B1 (0.41) AKR1B1HPGDHSP90AA1MAPK1NR1I2
SCHEMBL22138545 0.67 HSD17B10 (0.59) AKR1B1CYP3A4HPGDHSD17B10TSHR

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
US-12297311-B2 Biaryl hydroxythiophene group IV transition metal polymerization with chain transfer capability DOW GLOBAL TECHNOLOGIES LLC (US) 2025-05-13 US disclosed
US-12221508-B2 Biaryl phenoxy group IV transition metal catalysts for olefin polymerization DOW GLOBAL TECHNOLOGIES LLC (US) 2025-02-11 US disclosed
US-20220169756-A1 BIARYL HYDROXYTHIOPHENE GROUP IV TRANSITION METAL POLYMERIZATION WITH CHAIN TRANSFER CAPABILITY DOW GLOBAL TECHNOLOGIES LLC (US) 2022-06-02 US disclosed