SCHEMBL9502374

SCHEMBL9502374

CN1CCC=C(C(CCc2ccccc2)=NO)C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRM1 P11229 2/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
THRB P10828 1/20 0.39
CHRM3 P20309 1/20 0.39
BLM P54132 1/20 0.38
MCOLN3 Q8TDD5 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
SCHEMBL9502900 1.00 CHRNB2 (0.42) CHRNB2CHRNA4NPC1ALDH1A1RAB9A
SCHEMBL8215476 0.85 KMT2A (0.39) NPC1ALDH1A1RAB9ASMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL466882 0.84 KMT2A (0.40) NPC1ALDH1A1RAB9ASMN1; SMN2LMNA
SCHEMBL9502363 0.81 CHRNB2 (0.59) CHRNB2CHRNA4NPC1ALDH1A1RAB9A
SCHEMBL9504116 0.77 CHRNB2 (0.50) CHRNB2CHRNA4CHRM1LMNACHRM2
SCHEMBL9504121 0.77 CHRNB2 (0.50) CHRNB2CHRNA4CHRM1LMNACHRM2
SCHEMBL10564080 0.76 CHRNB2 (0.60) CHRNB2CHRNA4CHRM1LMNACHRM2
SCHEMBL10564077 0.76 CHRNB2 (0.60) CHRNB2CHRNA4CHRM1LMNACHRM2
SCHEMBL9506150 0.75 CHRM2 (0.50) CHRNB2CHRNA4CHRM1LMNACHRM2
SCHEMBL10566192 0.75 CHRNB2 (0.44) CHRNB2CHRNA4CHRM1LMNACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0291673-B1 TETRAHYDROPYRIDINE OXIMES, A PROCESS FOR THEIR PREPARATION AND USE THEREOF AS CHOLINERGIC AGENTS WARNER-LAMBERT COMPANY (US) 1993-06-02 EP claimed
US-4929734-A ANTIINFLAMMATORY AGENTS, ANTIDEPRESSANTS WARNER-LAMBERT COMPANY (US) 1990-05-29 US claimed
US-4798841-A COGNITION ACTIVATORS, ANALGESICS WARNER-LAMBERT COMPANY (US) 1989-01-17 US claimed
EP-0291673-A1 Tetrahydropyridine oximes, a process for their preparation and use thereof as cholinergic agents WARNER-LAMBERT COMPANY (US) 1988-11-23 EP claimed
EP-0291673-B1 TETRAHYDROPYRIDINE OXIMES, A PROCESS FOR THEIR PREPARATION AND USE THEREOF AS CHOLINERGIC AGENTS WARNER-LAMBERT COMPANY (US) 1993-06-02 EP disclosed
US-5073561-A N-substituted-pyridinyl oximes WARNER-LAMBERT COMPANY (US) 1991-12-17 US disclosed
US-4929734-A ANTIINFLAMMATORY AGENTS, ANTIDEPRESSANTS WARNER-LAMBERT COMPANY (US) 1990-05-29 US disclosed
US-4798841-A COGNITION ACTIVATORS, ANALGESICS WARNER-LAMBERT COMPANY (US) 1989-01-17 US disclosed
EP-0291673-A1 Tetrahydropyridine oximes, a process for their preparation and use thereof as cholinergic agents WARNER-LAMBERT COMPANY (US) 1988-11-23 EP disclosed
US-4710508-A ANALGESICS WARNER-LAMBERT COMPANY (US) 1987-12-01 US disclosed