SCHEMBL27387753

SCHEMBL27387753

CCc1c(CC)c2c(c([Zr])c1C1=CC=CC1)Cc1ccccc1-2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAP3K9 P80192 1/20 0.33
MAP3K11 Q16584 1/20 0.33
PNMT P11086 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
Hydrochloric Acid SCHEMBL27501681 0.84 MAP3K9 (0.35) MAP3K9MAP3K11
SCHEMBL27384415 0.83 MAP3K9 (0.32) MAP3K9MAP3K11
Hydrochloric Acid SCHEMBL7772201 0.81 MAP3K9 (0.30) MAP3K9MAP3K11
SCHEMBL27424771 0.80 PNMT (0.34) PNMT
Hydrochloric Acid SCHEMBL7774348 0.79 MAP3K9 (0.32) MAP3K9MAP3K11
SCHEMBL27429104 0.78
SCHEMBL723321 0.76 PNMT (0.40) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL7770513 0.76 MAP3K9 (0.30) MAP3K9MAP3K11
Hydrochloric Acid SCHEMBL7942532 0.76 MAP3K9 (0.30) MAP3K9MAP3K11
SCHEMBL6673850 0.76 PNMT (0.39) PNMT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1067087-C Process for production of cyclic olefin copolymer and copolymer produced by said process MITSUI CHEMICALS CO LTD (JP) 2001-06-13 CN disclosed
CN-1112570-A Process for production of cyclic olefin copolymer and copolymer produced by said process MITSUI PETROCHEMICAL IND (JP) 1995-11-29 CN disclosed