SCHEMBL11084663

SCHEMBL11084663

CC1(C)CC12C=Cc1ccccc12

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.35
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL29387054 0.73 KDM4E (0.39) OXTRKDM4EPKM
SCHEMBL251287 0.73 KDM4E (0.39) OXTRKDM4EPKM
Ammonia Solution, Strong SCHEMBL7086115 0.71 KDM4E (0.38) OXTRKDM4EPKM
SCHEMBL8375498 0.70 OXTR (0.36) OXTRKDM4EPKM
SCHEMBL8737325 0.70 OXTR (0.33) OXTRKDM4EPKM
SCHEMBL8861340 0.70 OXTR (0.33) OXTRKDM4EPKM
SCHEMBL5574452 0.70 KDM4E (0.37) OXTRKDM4EPKM
SCHEMBL5090884 0.70 OXTR (0.33) OXTRKDM4EPKM
Hydrochloric Acid SCHEMBL8675870 0.70 OXTR (0.33) OXTRKDM4EPKM
SCHEMBL19981020 0.70 OXTR (0.33) OXTRKDM4EPKM

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-4487778-A Insecticidal esters derived from benzocycloalkane-thiophenemethyl compounds FMC CORPORATION (US) 1984-12-11 US claimed