SCHEMBL10692503

SCHEMBL10692503

CCCN1CCCC(C(C)=O)C1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 12/20 0.58
BCHE P06276 7/20 0.56
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL27804698 0.90 BCHE (0.66) KDM2BBCHE
SCHEMBL13599987 0.89 KDM2B (0.47) KDM2BBCHESMN1; SMN2
SCHEMBL3842738 0.86 SMN1; SMN2 (0.68) KDM2BBCHESMN1; SMN2
SCHEMBL13149470 0.85 BCHE (0.47) KDM2BBCHESMN1; SMN2
SCHEMBL27454271 0.84 BCHE (0.51) KDM2BBCHE
SCHEMBL14609068 0.84 KDM2B (0.61) KDM2BBCHESMN1; SMN2
SCHEMBL12155343 0.84 BCHE (0.77) KDM2BBCHE
SCHEMBL12155272 0.83 KDM2B (0.56) KDM2BBCHESMN1; SMN2
Lithium Ion SCHEMBL10766583 0.83 KDM2B (0.59) KDM2BBCHE
SCHEMBL21214043 0.82 KDM2B (0.51) KDM2BBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4739067-A NERVOUS SYSTEM, PSYCHOLOGICAL DISORDERS, HYPOTENSIVE AGENT, HORMONE INHIBITORS WARNER-LAMBERT COMPANY (US) 1988-04-19 US disclosed
EP-0234011-A1 4-(1,2,5,6-tetrahydro-1-alkyl-3-pyridinyl)-2-thiazolamines and 4-(hexahydro-1-alkyl-3-pyridinyl)-2-thiazolamines WARNER-LAMBERT COMPANY (US) 1987-09-02 EP disclosed
US-4650805-A 4-(1,2,5,6-Tetrahydro-1-alkyl-3-pyridinyl)-2-thiazolamines and 4-(hexahydro-1-alkyl-3-pyridinyl)-2-thiazolamines having anti-psychotic activity WARNER-LAMBERT COMPANY (US) 1987-03-17 US disclosed