SCHEMBL6935299

SCHEMBL6935299

N#Cc1ccccc1NC(=O)C1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.69
▸ CETP P11597 1/20 0.61
▸ HDAC3 O15379 1/20 0.61
▸ HDAC1 Q13547 1/20 0.61
▸ HDAC2 Q92769 1/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.57
▸ HPGD P15428 2/20 0.55
▸ ALDH1A1 P00352 5/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ GAA P10253 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ NPC1 O15118 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ ADORA2A P29274 1/20 0.50
▸ ADORA1 P30542 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ CYP1A2 P05177 2/20 0.48

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
SCHEMBL28258088 0.84 CETP (0.77) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL12323604 0.84 CETP (0.77) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL28256535 0.84 CETP (0.77) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL28019538 0.78 GAA (0.53) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL28734434 0.78 CETP (0.69) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL19423434 0.78 CETP (0.69) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL21964290 0.77 KMT2A (0.53) KMT2AHDAC3HDAC1HDAC2ALDH1A1
SCHEMBL13212284 0.76 CETP (1.00) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL7733942 0.76 CETP (0.67) KMT2ACETPHDAC3HDAC1HDAC2
SCHEMBL6825065 0.76 P2RX7 (0.72) KMT2ACETPHDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000047-B1 1-(N-PHENYLAMINOALKYL)-PIPERAZINE DERIVATIVES SUBSTITUTED AT POSITION 2 OF THE PHENYL RING RECORDATI CHEM PHARM (CH) 2003-12-17 — — EP disclosed
CN-1127493-C 1-(N-phenylaminoalkyl)-piperazine derivatives substituted at position 2 of phenyl ring RECORDATI CHEM PHARM (CH) 2003-11-12 — — CN disclosed
US-6399614-B1 TREATING NEUROMUSCULAR DYSFUNCTION OF LOWER URINARY TRACT VIA PERIPHERAL OR CENTRAL NERVOUS SYSTEM; SEROTONIN RECEPTOR ANTAGONIST RECORDATI S.A. CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 2002-06-04 — — US disclosed
CN-1265654-A 1-(N-phenylaminoalkyl)-piperazine derivatives substituted at position 2 of phenyl ring RECORDATI CHEM PHARM (CH) 2000-09-06 — — CN disclosed
US-6071920-A BIND TO 5HT 1A RECEPTORS FOR TREATING DISORDERS OF THE LOWER URINARY TRACT; CNS DISORDERS; ANXIOLYTIC AGENTS; ANTIDEPRESSANTS; HYPOTENSIVE AGENTS; SLEEP AND EATING DISORDERS RECORDATI S.A. CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 2000-06-06 — — US disclosed
EP-1000047-A1 1-(N-PHENYLAMINOALKYL)-PIPERAZINE DERIVATIVES SUBSTITUTED AT POSITION 2 OF THE PHENYL RING RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 2000-05-17 — — EP disclosed
WO-1999006384-A1 1-(N-PHENYLAMINOALKYL)-PIPERAZINE DERIVATIVES SUBSTITUTED AT POSITION 2 OF THE PHENYL RING RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 1999-02-11 — — WO disclosed
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