SCHEMBL7607098

SCHEMBL7607098

Cc1cc(CCc2cc(C)c3c(c2C)Cc2ccccc2-3)c(C)c2c1-c1ccccc1C2.[Zr]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
MAP3K9 P80192 3/20 0.35
MAP3K11 Q16584 3/20 0.35
DRD2 P14416 3/20 0.34
PGR P06401 1/20 0.33
KDR P35968 3/20 0.33
NTRK1 P04629 2/20 0.33
MAP3K10 Q02779 2/20 0.33
PRKD3 O94806 1/20 0.33
PRKCG P05129 1/20 0.33
PRKCB P05771 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCH P24723 1/20 0.33
PRKCI P41743 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33

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 SCHEMBL7604670 0.95 PNMT (0.37) PNMTCA1CA2CA4CA6
SCHEMBL7605038 0.79 PNMT (0.43) PNMTCA1CA2CA4CA6
SCHEMBL8163015 0.78 MAP3K9 (0.41) PNMTCA1CA2CA4CA6
SCHEMBL31027164 0.78 NPC1 (0.40) PNMTCA1CA2CA4CA6
SCHEMBL8857192 0.77 PNMT (0.44) PNMTCA1CA2CA4CA6
Hydrochloric Acid SCHEMBL9170205 0.76 MAP3K9 (0.31) PNMTMAP3K9MAP3K11
Hydrochloric Acid SCHEMBL5358974 0.76 PNMT (0.42) PNMTCA1CA2CA4CA6
Hydrochloric Acid SCHEMBL5363324 0.76 PNMT (0.42) PNMTCA1CA2CA4CA6
SCHEMBL7606777 0.76 PNMT (0.49) PNMTCA1CA2CA4CA6
Hydrochloric Acid SCHEMBL7604176 0.75 MAP3K9 (0.38) PNMTCA1CA2CA4CA6

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
EP-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP claimed