SCHEMBL31395188

SCHEMBL31395188

COC(=O)c1cc(C)c2c(c1)CCN(c1ccc(Cl)c(Cl)c1)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.50
▸ SMN1; SMN2 Q16637 6/20 0.50
▸ RAB9A P51151 1/20 0.46
▸ HTT P42858 4/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ TP53 P04637 3/20 0.45
▸ POLB P06746 1/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ PANK3 Q9H999 1/20 0.41
▸ NOTUM Q6P988 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ CCR1 P32246 1/20 0.39
▸ CA2 P00918 2/20 0.38
▸ STS P08842 1/20 0.38

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
SCHEMBL31395120 0.85 MAPT (0.50) MAPTSMN1; SMN2RAB9AHTTMAPK1
SCHEMBL31395081 0.77 MAPT (0.40) MAPTSMN1; SMN2RAB9AHTTMAPK1
SCHEMBL31395059 0.77 MAPT (0.43) MAPTSMN1; SMN2RAB9AHTTMAPK1
SCHEMBL31395199 0.77 MAOB (0.43) MAPTSMN1; SMN2RAB9AHTTMAPK1
SCHEMBL25239226 0.74 MAPT (0.42) MAPTSMN1; SMN2RAB9AHTTMAPK1
SCHEMBL31395119 0.72 S1PR1 (0.50) MAPTSMN1; SMN2HTTMAPK1TP53
SCHEMBL15502972 0.70 ESR2 (0.54) MAPTRAB9AMAPK1KDM4ELMNA
SCHEMBL25206715 0.69 DRD1 (0.50) MAPTSMN1; SMN2RAB9AALDH1A1MEN1
SCHEMBL25574371 0.68 GPR142 (0.58) MAPTSMN1; SMN2RAB9AMAPK1MEN1
SCHEMBL17869278 0.68 NPC1 (0.58) MAPTSMN1; SMN2RAB9AHTTALDH1A1

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-2025049767-A1 AMIDE PRODRUGS AND USES THEREOF AUTOBAHN THERAPEUTICS, INC. (US) 2025-03-06 — — WO disclosed
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