SCHEMBL29429161

SCHEMBL29429161

CCOC(=O)c1c(CBr)n(C)c2cc(Br)ccc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
RAD52 P43351 1/20 0.47
KMT2A Q03164 4/20 0.47
TSHR P16473 1/20 0.47
ALOX5 P09917 5/20 0.47
KDM1A O60341 1/20 0.47
MEN1 O00255 1/20 0.47
APAF1 O14727 1/20 0.46
SMAD3 P84022 1/20 0.46
ALOX15 P16050 1/20 0.46
P4HB P07237 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL25942452 0.90 KDM1A (0.57) ALDH1A1SMN1; SMN2RAD52KMT2ATSHR
SCHEMBL25942412 0.89 TSHR (0.48) ALDH1A1SMN1; SMN2RAD52KMT2ATSHR
SCHEMBL25948631 0.86 RAD52 (0.52) ALDH1A1SMN1; SMN2RAD52KMT2ATSHR
SCHEMBL25946268 0.85 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2POLBGAAKMT2A
SCHEMBL25944378 0.84 ATM (0.46) ALDH1A1SMN1; SMN2POLBGAATSHR
SCHEMBL25941522 0.83 KDM4E (0.60) ALDH1A1SMN1; SMN2GAAKMT2ATSHR
SCHEMBL25944688 0.82 KMT2A (0.57) ALDH1A1SMN1; SMN2POLBGAAKMT2A
SCHEMBL25938505 0.82 RAD52 (0.48) ALDH1A1SMN1; SMN2RAD52KMT2ATSHR
SCHEMBL25942550 0.81 ALOX5 (0.49) ALDH1A1SMN1; SMN2POLBGAAKMT2A
SCHEMBL25947796 0.80 ALDH1A1 (0.51) ALDH1A1GAARAD52KMT2ATSHR

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
CN-111269168-B Preparation method of arbidol intermediate 苏州敬业医药化工有限公司 2022-04-01 CN claimed
CN-120607474-A Synthesis and refining method of arbidol hydrochloride intermediate 苏州亚科科技股份有限公司 2025-09-09 CN disclosed