SCHEMBL7937284

SCHEMBL7937284

O=C(O)C(=NC12CC3CC(CC(C3)C1)C2)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.56
EPHX2 P34913 9/20 0.52
EPHX1 P07099 2/20 0.52
FAAH O00519 1/20 0.44
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL2740883 0.75 SIGMAR1 (0.66) SIGMAR1EPHX2EPHX1
SCHEMBL4431734 0.74 EPHX2 (0.67) EPHX2EPHX1FAAHKMT2ASMN1; SMN2
SCHEMBL30500314 0.72 EPHX2 (0.70) EPHX2EPHX1FAAHKMT2ASMN1; SMN2
SCHEMBL1694443 0.72 EPHX2 (0.70) EPHX2EPHX1FAAHKMT2ASMN1; SMN2
SCHEMBL6155761 0.72 SIGMAR1 (0.67) SIGMAR1EPHX2EPHX1KMT2A
SCHEMBL6156054 0.72 SIGMAR1 (1.00) SIGMAR1EPHX2EPHX1
SCHEMBL3073550 0.72 SIGMAR1 (1.00) SIGMAR1EPHX2EPHX1KMT2ASMN1; SMN2
SCHEMBL3073552 0.72 SIGMAR1 (1.00) SIGMAR1EPHX2EPHX1KMT2ASMN1; SMN2
SCHEMBL3075099 0.71 SIGMAR1 (0.51) SIGMAR1EPHX2EPHX1FAAH
Hydrochloric Acid SCHEMBL6158171 0.70 SIGMAR1 (1.00) SIGMAR1EPHX2EPHX1

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-6228794-B1 EFFECTIVELY CATALYZE POLYMERIZATION OF OLEFINS IN ABSENCE OF ANY TRANSITION METAL UNIVERSITY OF IOWA RESEARCH FOUNDATION 2001-05-08 US disclosed