SCHEMBL13239093

SCHEMBL13239093

Cc1cc2c(s1)-c1c(c(C=O)nn1-c1ccc(F)cc1F)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HDAC9 Q9UKV0 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CNR2 P34972 10/20 0.32
▸ CNR1 P21554 6/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ GLA P06280 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL2772643 0.82 L3MBTL1 (0.43) L3MBTL1CNR2CNR1
SCHEMBL16162162 0.81 CNR1 (0.43) CNR2CNR1
SCHEMBL2773654 0.78 KDM4E (0.43) L3MBTL1CNR2CNR1LMNAMAPT
SCHEMBL13238761 0.70 RAB9A (0.36) L3MBTL1HDAC9NPC1RAB9AMAPT
SCHEMBL2774194 0.69 L3MBTL1 (0.39) L3MBTL1CNR2CNR1
SCHEMBL13156937 0.69 CNR2 (0.45) L3MBTL1NPC1RAB9ACNR2CNR1
SCHEMBL2773251 0.69 KDM4E (0.43) L3MBTL1CNR2CNR1LMNAMAPT
SCHEMBL13157146 0.65 CNR2 (0.41) CNR2CNR1
SCHEMBL2774623 0.64 MAPT (0.43) L3MBTL1NPC1RAB9ACNR2CNR1
SCHEMBL496034 0.63 CNR2 (0.49) CNR2CNR1

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-20100215759-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENZE PHARMANESS S.C.A.R.L. (IT) 2010-08-26 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100215759-A1 PHARMACEUTICAL COMPOUNDS CNR2, CNR1, OPRK1 OPRM1 4/4885L3MBTL1 4607/4885HDAC9 870/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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