SCHEMBL10677264

SCHEMBL10677264

c1ccc(CCCN2CCNCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 14/20 1.00
POLB P06746 1/20 0.64
LTA4H P09960 1/20 0.62
CCR3 P51677 1/20 0.59

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
SCHEMBL457139 1.00 SIGMAR1 (1.00) SIGMAR1POLBLTA4HCCR3
SCHEMBL20676401 0.98 SIGMAR1 (0.96) SIGMAR1POLBLTA4HCCR3
Hydrochloric Acid SCHEMBL7554612 0.98 SIGMAR1 (0.96) SIGMAR1POLBLTA4HCCR3
SCHEMBL3251614 0.95 SIGMAR1 (0.90) SIGMAR1POLBCCR3
SCHEMBL3246702 0.93 SIGMAR1 (0.87) SIGMAR1POLBLTA4H
Hydrochloric Acid SCHEMBL7986308 0.92 SIGMAR1 (0.84) SIGMAR1POLBLTA4H
SCHEMBL20676123 0.91 SIGMAR1 (0.84) SIGMAR1POLBCCR3
SCHEMBL28187150 0.89 SIGMAR1 (0.81) SIGMAR1POLBLTA4HCCR3
SCHEMBL41969 0.89 SIGMAR1 (0.79) SIGMAR1LTA4HCCR3
SCHEMBL3963041 0.89 SIGMAR1 (0.79) SIGMAR1LTA4HCCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4735959-A HYPOGLYCEMIC AGENTS DR. KARL THOMAE GMBH (DE) 1988-04-05 US disclosed