SCHEMBL26522392

SCHEMBL26522392

CN(Cc1ccc(Br)cc1)SC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PYCR1 P32322 8/20 0.44
▸ MAOB P27338 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ TAAR1 Q96RJ0 2/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ CTSK P43235 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34
▸ MAPK1 P28482 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
SCHEMBL23377510 0.81 RIPK1 (0.46) PYCR1ALDH1A1TAAR1LMNAHRH3
SCHEMBL9804910 0.80 TSHR (0.52) PYCR1MAOBKDM4EALDH1A1TAAR1
Hydrochloric Acid SCHEMBL9804592 0.78 TSHR (0.50) PYCR1MAOBALDH1A1TAAR1TSHR
Hydrochloric Acid SCHEMBL9804606 0.77 PYCR1 (0.46) PYCR1MAOBALDH1A1TAAR1TSHR
SCHEMBL399795 0.72 HRH3 (0.64) PYCR1MAOBKDM4EALDH1A1TAAR1
SCHEMBL15128047 0.72 PYCR1 (0.67) PYCR1MAOBKDM4EALDH1A1TAAR1
SCHEMBL10138441 0.71 PYCR1 (0.46) PYCR1MAOBKDM4EALDH1A1TAAR1
SCHEMBL18598042 0.69 AOC3 (0.60) PYCR1MAOBKDM4EALDH1A1TAAR1
SCHEMBL1241075 0.67 KDM4E (0.69) PYCR1MAOBKDM4EALDH1A1TAAR1
SCHEMBL15975291 0.66 PYCR1 (0.41) PYCR1MAOBKDM4EALDH1A1L3MBTL1

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
WO-2023192506-A1 MALT1 MODULATORS AND USES THEREOF RARIFIED BIOSCIENCES, INC. (US) 2023-10-05 — — WO disclosed
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