SCHEMBL9557186

SCHEMBL9557186

O=C(CCCCCc1ccc(Cl)cc1)N1CC=CCC1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.55
▸ NPC1 O15118 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ HDAC7 Q8WUI4 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC10 Q969S8 1/20 0.47
▸ HDAC11 Q96DB2 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ HDAC9 Q9UKV0 1/20 0.47
▸ HDAC5 Q9UQL6 1/20 0.47
▸ DPP7 Q9UHL4 1/20 0.46
▸ HRH3 Q9Y5N1 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
SCHEMBL9557059 0.95 RAB9A (0.51) NAAANPC1LMNARAB9ATDP1
SCHEMBL9557028 0.90 NAAA (0.58) NAAAHDAC1HDAC3HDAC4HDAC7
SCHEMBL9557043 0.89 NPC1 (0.54) NAAANPC1LMNARAB9ATDP1
SCHEMBL9557015 0.87 NAAA (0.53) NAAA
SCHEMBL9557053 0.86 NAAA (0.53) NAAANPC1RAB9ATDP1
SCHEMBL9557044 0.85 NAAA (0.54) NAAA
SCHEMBL9557038 0.85 TRPV1 (0.43) NAAA
SCHEMBL9557179 0.85 MAOA (0.52) NAAANPC1RAB9ATDP1
SCHEMBL9557091 0.84 MAOA (0.52) —
SCHEMBL9557185 0.82 MAOA (0.53) —

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
US-5198450-A PHENYLALKANOYLAMINE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USAGE OF THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-03-30 — — US disclosed
EP-0424528-A1 PHENYLALKANOYLAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-05-02 — — EP disclosed
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