SCHEMBL9501178

SCHEMBL9501178

C=CC1CCCCC1CC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.40
CHRNA7 P36544 2/20 0.40
CHRNA4 P43681 2/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 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
SCHEMBL17100043 0.79 CYP1A2 (0.43) CHRNB2CHRNA7CHRNA4CA1CA2
SCHEMBL11430868 0.76 CA1 (0.37) CA1CA2CA4
SCHEMBL7336141 0.76 TDP1 (0.38)
SCHEMBL7332966 0.76 TDP1 (0.38)
SCHEMBL14639737 0.76 TDP1 (0.38)
SCHEMBL7295356 0.76 TSHR (0.30)
SCHEMBL14639885 0.76 ADH1A (0.34) CA1CA2CA4
SCHEMBL7295327 0.76 TSHR (0.30)
SCHEMBL7335272 0.76 TSHR (0.30)
SCHEMBL7295329 0.76 TSHR (0.30)

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-0322731-B1 VINYLCYCLOHEXANE-BASED POLYMERS AND PROCESS FOR PRODUCTION THEREOF IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-04-14 EP claimed
US-4997898-A Vinylcyclohexane-based polymers and process for production thereof IDEMITSU KOSAN CO., LTD. (JP) 1991-03-05 US claimed
EP-0322731-A2 Vinylcyclohexane-based polymers and process for production thereof IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-07-05 EP claimed
WO-2017184870-A1 DIASTEREOSELECTIVE SYNTHESIS OF (±)-EPIANASTREPHIN, (±)-ANASTREPHIN AND ANALOGS THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2017-10-26 WO disclosed
EP-0322731-B1 VINYLCYCLOHEXANE-BASED POLYMERS AND PROCESS FOR PRODUCTION THEREOF IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-04-14 EP disclosed
US-4997898-A Vinylcyclohexane-based polymers and process for production thereof IDEMITSU KOSAN CO., LTD. (JP) 1991-03-05 US disclosed
EP-0322731-A2 Vinylcyclohexane-based polymers and process for production thereof IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-07-05 EP disclosed