SCHEMBL9516164

SCHEMBL9516164

O=C1C2CCCCC2C(=O)N1CCS

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TP53 P04637 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL9516183 0.88 ALDH1A1 (0.44) ALDH1A1HTTRAB9ASMN1; SMN2ATM
SCHEMBL17532412 0.86 ALDH1A1 (0.53) ALDH1A1HTTRAB9ASMN1; SMN2ATM
SCHEMBL17532416 0.82 ALDH1A1 (0.50) ALDH1A1HTTRAB9ASMN1; SMN2ATM
SCHEMBL10948563 0.80 ALDH1A1 (0.49) ALDH1A1HTTRAB9ASMN1; SMN2TP53
SCHEMBL17532423 0.80 ALDH1A1 (0.49) ALDH1A1HTTRAB9ASMN1; SMN2TP53
SCHEMBL1147308 0.80 ALDH1A1 (0.48) ALDH1A1HTTRAB9ASMN1; SMN2ATM
SCHEMBL1147309 0.78 ALDH1A1 (0.47) ALDH1A1HTTRAB9ASMN1; SMN2ATM
SCHEMBL17549818 0.78 ALDH1A1 (0.47) ALDH1A1HTTRAB9ASMN1; SMN2KMT2A
SCHEMBL10883243 0.77 ALDH1A1 (0.53) ALDH1A1HTTRAB9ATP53KMT2A
SCHEMBL11510536 0.75 HTT (0.51) ALDH1A1HTTRAB9ASMN1; SMN2L3MBTL1

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
EP-0465342-B1 REDUCING COSMETIC COMPOSITION FOR PERMING CONTAINING A DERIVATIVE OF A N-(MERCAPTO-ALKYL)SUCCINAMIC ACID OR A N-(MERCAPTO-ALKYL)SUCCINIMID AND ITS USE IN A PROCESS FOR PERMANENT HAIR SHAPING L'OREAL (FR) 1993-09-29 EP claimed
US-5154918-A COSMETIC COMPOSITION FOR USE IN PERMANENT DEFORMATION OF HAIR CONTAINS AS A REDUCING AGENT A DERIVATIVE OF N-(MERCAPTO ALKYL) SUCCINAMIC ACID OR OF N-(MERCAPTO ALKYL) SUCCINIMIDE L'OREAL (FR) 1992-10-13 US disclosed