SCHEMBL7390806

SCHEMBL7390806

CC(=O)NC1(C)CCN(c2ccnc(Cl)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 12/20 0.49
▸ OGA O60502 1/20 0.40
▸ SORD Q00796 2/20 0.40
▸ HDAC3 O15379 4/20 0.39
▸ HDAC4 P56524 4/20 0.39
▸ HDAC1 Q13547 4/20 0.39
▸ HDAC7 Q8WUI4 4/20 0.39
▸ HDAC2 Q92769 4/20 0.39
▸ HDAC10 Q969S8 4/20 0.39
▸ HDAC11 Q96DB2 4/20 0.39
▸ HDAC8 Q9BY41 4/20 0.39
▸ HDAC6 Q9UBN7 4/20 0.39
▸ HDAC9 Q9UKV0 4/20 0.39
▸ HDAC5 Q9UQL6 4/20 0.39

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
SCHEMBL7391819 0.83 TRPV1 (0.44) TRPV1
SCHEMBL7393573 0.81 HTR3E (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7386664 0.80 PANK3 (0.48) —
SCHEMBL20361410 0.79 TRPV1 (0.46) TRPV1OGASORD
SCHEMBL7395300 0.76 PTPN11 (0.48) —
SCHEMBL30621975 0.76 TRPV1 (0.41) TRPV1OGASORD
SCHEMBL29097705 0.76 TRPV1 (0.41) TRPV1OGASORD
SCHEMBL7384813 0.75 KDM4E (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21193615 0.75 TRPV1 (0.62) TRPV1SORD
Fumaric Acid SCHEMBL8697083 0.75 TRPV1 (0.45) TRPV1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5723611-A Heteroarylpiperidines SANOFI (FR) 1998-03-03 — — US disclosed
US-5595994-A 1-Halopyrazin- and 1-halopyrimidin-4-amino-4-alkylpiperidines SANOFI (FR) 1997-01-21 — — US disclosed
US-5502063-A 1-halopyridin-4-amino-4-alkylpiperidines SANOFI (FR) 1996-03-26 — — US disclosed
EP-0647639-A1 Heteroarylpiperidines, process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1995-04-12 — — EP disclosed
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