SCHEMBL7043435

SCHEMBL7043435

CCCC(N)N(CC)C(N)CCC

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.33
PLA2G2A P14555 1/20 0.33
OPRM1 P35372 1/20 0.32
METAP1 P53582 2/20 0.31

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
SCHEMBL187299 0.77 PLA2G1B (0.33) PLA2G1BPLA2G2AOPRM1METAP1
SCHEMBL8806714 0.75 OPRM1 (0.35) PLA2G1BPLA2G2AOPRM1METAP1
SCHEMBL3098182 0.75
SCHEMBL7771795 0.73 OPRM1 (0.33) PLA2G1BPLA2G2AOPRM1METAP1
SCHEMBL8373021 0.73 OPRM1 (0.33) PLA2G1BPLA2G2AOPRM1METAP1
SCHEMBL23642578 0.73
SCHEMBL187617 0.73
SCHEMBL4955499 0.71 ALDH1A1 (0.41) METAP1
SCHEMBL27789399 0.71 PLA2G1B (0.31) PLA2G1BPLA2G2AOPRM1
SCHEMBL3460907 0.71 OPRM1 (0.38) OPRM1METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030060658-A1 Process for preparing sorbic acid by thermal cleavage NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2003-03-27 US disclosed
EP-0736070-B1 PROCESS FOR MAKING A NON-AQUEOUS DISPERSION OF A COOPER PHTHALOCYANINE ZENECA LTD (GB) 1999-02-24 EP disclosed
US-5753022-A FOR PREPARING NONAQUEOUS DISPERSION OF COPPER PHTHALOCYANINE BY MILLING IN A HIGH BOILING LIQUID IN THE PRESENCE OF A POLYESTER AMINE OR POLYESTERAMMONIUM SALT SALT AND A FLUIDIZING AGENT ZENECA LIMITED (GB) 1998-05-19 US disclosed
EP-0736070-A1 PROCESS FOR MAKING A NON-AQUEOUS DISPERSION OF A COOPER PHTHALOCYANINE ZENECA LIMITED (GB) 1996-10-09 EP disclosed
WO-1995017473-A1 PROCESS FOR MAKING A NON-AQUEOUS DISPERSION OF A COOPER PHTHALOCYANINE ZENECA LIMITED (GB) 1995-06-29 WO disclosed