SCHEMBL31475470

SCHEMBL31475470

Cc1ccc2[nH]c(=O)c(Br)c(C)c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 5/20 0.58
▸ MAPT P10636 4/20 0.58
▸ TSHR P16473 1/20 0.58
▸ HTT P42858 1/20 0.58
▸ KDM4E B2RXH2 8/20 0.52
▸ RECQL P46063 1/20 0.52
▸ ALDH1A1 P00352 6/20 0.51
▸ CHEK1 O14757 2/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ HPGD P15428 4/20 0.46
▸ LMNA P02545 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ DAO P14920 1/20 0.45
▸ TP53 P04637 1/20 0.44
▸ ALOX15 P16050 1/20 0.43

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
SCHEMBL28787087 0.83 LMNA (0.56) KDM4ECHEK1NPC1MEN1KMT2A
SCHEMBL21977684 0.78 DAO (0.62) HSD17B10MAPTHTTKDM4EALDH1A1
SCHEMBL31018132 0.78 DAO (0.62) HSD17B10MAPTHTTKDM4EALDH1A1
SCHEMBL14355039 0.76 ALDH1A1 (0.56) HSD17B10MAPTTSHRHTTKDM4E
SCHEMBL9724158 0.75 HSD17B10 (0.61) HSD17B10MAPTTSHRKDM4EALDH1A1
SCHEMBL8210527 0.75 KDM4E (0.58) HSD17B10MAPTTSHRHTTKDM4E
SCHEMBL25834663 0.75 LMNA (0.53) HSD17B10MAPTTSHRHTTKDM4E
SCHEMBL16747721 0.73 PDE3B (0.57) HSD17B10MAPTTSHRHTTKDM4E
SCHEMBL13174592 0.72 ALDH1A1 (0.56) HSD17B10MAPTTSHRHTTKDM4E
SCHEMBL30547023 0.72 ALDH1A1 (0.56) HSD17B10MAPTTSHRHTTKDM4E

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-119604290-A Compounds for the treatment of coronavirus infections 特劳斯芬尼德治疗股份有限公司 2025-03-11 — — CN disclosed
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