SCHEMBL6280915

SCHEMBL6280915

C=CCNN[CH]CCCC

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
ALDH1A1 P00352 1/20 0.48
FAAH O00519 1/20 0.36

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
SCHEMBL4119803 0.77
SCHEMBL8909344 0.71 TSHR (0.52) TSHRALDH1A1FAAH
SCHEMBL28591833 0.70 TSHR (0.48) TSHRALDH1A1FAAH
SCHEMBL1341309 0.68 FAAH (0.42) TSHRALDH1A1FAAH
SCHEMBL15519857 0.68 FAAH (0.42) TSHRALDH1A1FAAH
Hydrazine SCHEMBL11500590 0.68
Methylamine SCHEMBL27467229 0.68 TSHR (0.88) TSHRALDH1A1
SCHEMBL2137 0.67
SCHEMBL2405672 0.67 TSHR (1.00) TSHRALDH1A1
SCHEMBL9420916 0.67 TSHR (1.00) TSHRALDH1A1

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
EP-1606019-A1 CANNABINOID RECEPTOR INVERSE AGONISTS AND NEUTRAL ANTAGONISTS AS THERAPEUTIC AGENTS FOR THE TREATMENT OF BONE DISORDERS The University Court of The University of Aberdeen (GB) 2005-12-21 EP claimed
WO-2004078261-A1 CANNABINOID RECEPTOR INVERSE AGONISTS AND NEUTRAL ANTAGONISTS AS THERAPEUTIC AGENTS FOR THE TREATMENT OF BONE DISORDERS THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2004-09-16 WO claimed