SCHEMBL9502380

SCHEMBL9502380

CN1CCC=C(CC(Cc2ccccc2)=NO)C1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
CHRM1 P11229 1/20 0.34
CTBP2 P56545 1/20 0.34
MC4R P32245 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LSS P48449 1/20 0.33

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
SCHEMBL9502372 1.00 TSHR (0.35) TSHRALOX12CHRM1CTBP2MC4R
SCHEMBL9875369 0.84 DRD2 (0.35) ALOX12
SCHEMBL9875372 0.84 DRD2 (0.35) ALOX12
SCHEMBL9876403 0.75 CHRM2 (0.37) CHRM1CHRNB2CHRNA4
SCHEMBL10741609 0.74 CHRNB2 (0.40) CHRM1CHRNB2CHRNA4
SCHEMBL10741620 0.74 CHRNB2 (0.40) CHRM1CHRNB2CHRNA4
SCHEMBL3966062 0.73 CTBP2 (0.56) TSHRCTBP2L3MBTL1
SCHEMBL6771065 0.70 TSHR (0.38) TSHRCHRM1CHRNB2CHRNA4
SCHEMBL6771063 0.70 TSHR (0.38) TSHRCHRM1CHRNB2CHRNA4
SCHEMBL9502374 0.69 CHRNB2 (0.42) CHRM1CHRNB2CHRNA4

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 6 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 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