SCHEMBL11792802

SCHEMBL11792802

CC1CC=CCC1C(=O)C1CC=CCC1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.30
EPHX1 P07099 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
SCHEMBL264855 0.84 POLB (0.43) POLBTDP1KDM4EALDH1A1GAA
SCHEMBL14016281 0.84 POLB (0.43) POLBTDP1KDM4EALDH1A1GAA
SCHEMBL2916591 0.84 POLB (0.43) POLBTDP1KDM4EALDH1A1GAA
SCHEMBL6914871 0.84 POLB (0.43) POLBTDP1KDM4EALDH1A1GAA
SCHEMBL6914864 0.84 POLB (0.43) POLBTDP1KDM4EALDH1A1GAA
SCHEMBL10146298 0.84 POLB (0.43) POLBTDP1KDM4EALDH1A1GAA
SCHEMBL14189983 0.82 MAPT (0.32) POLB
SCHEMBL1786596 0.82 MAPT (0.32) POLB
SCHEMBL19034278 0.80 POLB (0.30) POLB
SCHEMBL16782435 0.78 POLB (0.36) POLBTDP1ALDH1A1

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-3966822-A DECARBOXYLATION CATALYSTS, ZIRCONIUM OXIDE, ALKALI OR ALKALINE EARTH METAL OXIDES CHISSO CORPORATION (JA) 1976-06-29 US disclosed