SCHEMBL7525622

SCHEMBL7525622

CC(C)CCC(C)C.N=C=O.N=C=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.35
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
TRPM8 Q7Z2W7 1/20 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
SCHEMBL11227380 0.87 LMNA (0.50) CA1ALDH1A1LMNA
SCHEMBL3125185 0.84
SCHEMBL216382 0.84 TSHR (0.33) CA1TRPM8
SCHEMBL28417881 0.84 LMNA (0.48) CA1LMNA
SCHEMBL9084460 0.80 OPRM1 (0.35) CA1ALDH1A1
SCHEMBL4810926 0.80 LMNA (0.38) CA1LMNATRPM8
SCHEMBL834041 0.79
SCHEMBL11228055 0.79 ALDH1A1 (0.37) ALDH1A1
SCHEMBL5696405 0.79 TSHR (0.33) TRPM8
SCHEMBL11344550 0.78 OPRM1 (0.44) CA1LMNATRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0770923-B1 Photosensitive resin composition and photosensitive resin laminated film containing the same TOKYO OHKA KOGYO CO LTD (JP) 2002-03-27 EP disclosed
US-5919569-A CONTAINING A PHOTOPOLYMERIZABLE ACRYLATED POLYURETHANE TOKYO OHKA KOGYO CO., LTD. (JP) 1999-07-06 US disclosed
US-5776995-A PHOTOPOLYMERIZABLE URETHANE (METH)ACRYLATE COMPOUND, ALKALI-SOLUBLE POLYMER, PHOTOPOLYMERIZATION INITIATOR, COMPLEX OF ALKALI THIOCYANTE WITH POLYETHER TOKYO OHKA KOGYO CO., LTD. (JP) 1998-07-07 US disclosed
EP-0770923-A1 Photosensitive resin composition and photosensitive resin laminated film containing the same TOKYO OHKA KOGYO CO., LTD. (JP) 1997-05-02 EP disclosed
US-4411752-A Preparation of 1-monochloroethylcarbamyl chloride BASF AKTIENGESELLSCHAFT (DE) 1983-10-25 US disclosed
US-4344891-A Halogenated tertiary alkyl isocyanates and their preparation BASF AKTIENGESELLSCHAFT (DE) 1982-08-17 US disclosed
US-4314948-A Preparation of mixtures of 1-monohalogenated isocyanates and 1,2-unsaturated isocyanates BASF AKTIENGESELLSCHAFT (DE) 1982-02-09 US disclosed