SCHEMBL1768210

SCHEMBL1768210

Clc1cccc(Br)c1-c1ccccc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.46
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 1/20 0.44
ELANE P08246 1/20 0.41
CYP2A6 P11509 3/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
PDK2 Q15119 2/20 0.38
NPC1 O15118 2/20 0.36
HPGD P15428 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 2/20 0.35
TP53 P04637 1/20 0.34
PBRM1 Q86U86 1/20 0.34
ADORA2A P29274 1/20 0.34

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
SCHEMBL20961408 0.93 HSD11B1 (0.47) HSD11B1ALDH1A1MAPK1ELANECYP2A6
SCHEMBL23609502 0.91 HSD11B1 (0.46) HSD11B1ALDH1A1MAPK1ELANECYP2A6
SCHEMBL26191582 0.84 ALDH1A1 (0.54) HSD11B1ALDH1A1MAPK1ELANECYP2A6
SCHEMBL29803148 0.83 ALDH1A1 (0.55) HSD11B1ALDH1A1MAPK1LMNATSHR
SCHEMBL1768545 0.83 ALDH1A1 (0.55) HSD11B1ALDH1A1MAPK1LMNATSHR
SCHEMBL26191589 0.82 CYP2A6 (0.52) HSD11B1ALDH1A1ELANECYP2A6CA1
SCHEMBL30523567 0.79 MAPK1 (0.54) HSD11B1ALDH1A1MAPK1ELANECYP2A6
SCHEMBL18795084 0.79 APP (0.46) ALDH1A1ELANETSHRCA1CA2
SCHEMBL10664062 0.78 HSD11B1 (0.55) HSD11B1ALDH1A1MAPK1ELANECYP2A6
SCHEMBL30097499 0.78 HSD11B1 (0.55) HSD11B1ALDH1A1MAPK1ELANECYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025009841-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2025-01-09 WO disclosed
WO-2011061439-A1 CATALYTIC PHOSPHINATION METHOD UNIVERSITE DE STRASBOURG (FR) 2011-05-26 WO disclosed