SCHEMBL7656281

SCHEMBL7656281

CCOC1CC(=O)N1C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TSHR P16473 2/20 0.39
OPRM1 P35372 2/20 0.38
OPRL1 P41146 2/20 0.38
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CASP3 P42574 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL7657267 0.70
SCHEMBL11229667 0.70 LMNA (0.41) OPRM1OPRL1LMNANPSR1GSK3A
SCHEMBL9800228 0.64 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL7663878 0.63 GAA (0.43) SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL11492801 0.61 TSHR (0.35) TSHRNPSR1
SCHEMBL3287190 0.61 MAPK1 (0.38) ALDH1A1OPRM1OPRL1LMNANPSR1
SCHEMBL8444083 0.61 DPP4 (0.37) ALDH1A1TSHROPRM1OPRL1GSK3A
SCHEMBL2230464 0.61 POLB (0.37) ALDH1A1TSHRLMNACYP2C9CYP2C19
SCHEMBL4681766 0.61 HTT (0.43) SMN1; SMN2ALDH1A1LMNAGSK3AGSK3B
SCHEMBL2991774 0.61 HTT (0.43) SMN1; SMN2ALDH1A1LMNAGSK3AGSK3B

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-6407228-B1 MIXING ISOCYANATE WITH VINYL ETHER; CYCLIZATION JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2002-06-18 US disclosed