SCHEMBL9054451

SCHEMBL9054451

CC(c1cnc(C(C)N(C)C)cn1)N(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.30

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
SCHEMBL9054360 0.74
SCHEMBL5950443 0.69 NOS3 (0.33) APLNR
SCHEMBL22101681 0.69
SCHEMBL6226578 0.69 TSHR (0.55)
SCHEMBL522348 0.69 IRAK4 (0.40)
SCHEMBL9771904 0.67 IRAK4 (0.34)
SCHEMBL179338 0.65 CKS1B (0.33)
SCHEMBL28807428 0.65 ESR1 (0.31)
SCHEMBL5842338 0.65 APLNR (0.37) APLNR
SCHEMBL29670493 0.64 KDM4E (0.34)

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
WO-1996000248-A1 WATER MISCIBLE NON-HYDROLYZABLE CROSS-LINKERS AND HIGH REFRACTIVE INDEX HYDROGELS PREPARED THEREWITH KABI PHARMACIA OPHTHALMICS, INC. (US) 1996-01-04 WO claimed
US-5439950-A Intraocular lenses KABI PHARMACIA OPHTHALMICS, INC. (US) 1995-08-08 US disclosed