SCHEMBL38650656

SCHEMBL38650656

CC(C)Oc1ccc(C=CBr)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.59
NPC1 O15118 2/20 0.42
SIRT2 Q8IXJ6 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 2/20 0.42
PARP10 Q53GL7 1/20 0.41
TRPA1 O75762 1/20 0.41
RELA Q04206 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
POLB P06746 1/20 0.39
MTOR P42345 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL20024678 0.87 ALDH1A3 (0.68) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL25836762 0.83 TRPA1 (0.61) ALDH1A3NPC1LMNARAB9ASMN1; SMN2
SCHEMBL28733919 0.81 ALDH1A3 (0.61) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL11321912 0.79 ALDH1A3 (0.59) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL8747588 0.79 ALDH1A3 (0.59) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL8747586 0.79 ALDH1A3 (0.59) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL7789915 0.78 ALDH1A3 (0.57) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL7789912 0.78 ALDH1A3 (0.57) ALDH1A3NPC1SIRT2LMNAGAA
SCHEMBL125543 0.76 ALDH1A3 (0.64) ALDH1A3LMNAGAAKMT2APARP10
SCHEMBL5634506 0.76 ALDH1A3 (0.66) ALDH1A3NPC1SIRT2LMNAGAA

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-122010675-A Method for synthesizing 1-bromo-2-styrene derivative by metal bromide catalysis 杭州师范大学 2026-05-12 CN disclosed