SCHEMBL9705878

SCHEMBL9705878

ICc1ccc(OCCCCOc2ccc(CI)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.44
HRH3 Q9Y5N1 2/20 0.44
PRSS1 P07477 1/20 0.43
APP P05067 1/20 0.43

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
SCHEMBL14168915 0.92 APP (0.44) KCNA3HRH3PRSS1APP
SCHEMBL5169443 0.89 NR5A1 (0.58)
SCHEMBL15086522 0.88 APP (0.41) KCNA3HRH3APP
SCHEMBL21379240 0.88 NR5A1 (0.61)
SCHEMBL14280618 0.86 APP (0.47) L3MBTL1HRH3APP
SCHEMBL15086546 0.84 LMNA (0.53) L3MBTL1
SCHEMBL14280603 0.82 ACACB (0.42) HRH3APP
SCHEMBL23358307 0.79 HRH3 (0.49) KCNA3L3MBTL1HRH3
SCHEMBL19632708 0.79 HTR1B (0.60) L3MBTL1
SCHEMBL11428481 0.78 NQO1 (0.67) PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0228803-B1 IONENE ELASTOMERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-09-16 EP claimed
EP-0228803-A2 Ionene elastomers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-07-15 EP claimed
US-4677182-A COATINGS, ADHESIVES MINNESOTA MINING AND MANUFACTURING CO. (US) 1987-06-30 US claimed
EP-0228803-B1 IONENE ELASTOMERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-09-16 EP disclosed
US-4794031-A POLYMERIC DIAMINES, DIHALIDE LINKING AGENTS, POLYETHERS, ACRYLIC COPOLYMERS, ENCAPPING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-12-27 US disclosed
US-4734458-A QUATERNIZED POLYAMINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-03-29 US disclosed
EP-0228803-A2 Ionene elastomers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-07-15 EP disclosed
US-4677182-A COATINGS, ADHESIVES MINNESOTA MINING AND MANUFACTURING CO. (US) 1987-06-30 US disclosed