SCHEMBL31483115

SCHEMBL31483115

Cc1ccc(Cl)c(CB(O)O)c1Br

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL19810453 0.79 NOTUM (0.33) HDAC8ALDH1A1LMNA
SCHEMBL31483121 0.71 CYP3A4 (0.30)
SCHEMBL29953504 0.69 AKR1B1 (0.46) ALDH1A1LMNA
SCHEMBL4448674 0.68 CYP3A4 (0.37) ALDH1A1LMNA
SCHEMBL19830027 0.66 CYP3A4 (0.36) ALDH1A1LMNA
SCHEMBL27952945 0.66 CYP3A4 (0.36) ALDH1A1
SCHEMBL29080438 0.65 ALDH1A1 (0.42) ALDH1A1LMNA
SCHEMBL31483105 0.63 HTR2A (0.35)
SCHEMBL22162367 0.63 HTR2A (0.35)
SCHEMBL31483162 0.63 CYP3A4 (0.43) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119841705-A Preparation method of 2-bromo-4-chloro-3-fluorotoluene 浙江凯普化工有限公司 2025-04-18 CN disclosed