SCHEMBL5069737

SCHEMBL5069737

Cc1ccc(F)cc1-c1c(Cl)[c]c(Cl)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 1/20 0.36
▸ PDE2A O00408 3/20 0.35
▸ PDE10A Q9Y233 3/20 0.35
▸ ABL1 P00519 2/20 0.35
▸ AGPAT2 O15120 1/20 0.34
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HSD11B1 P28845 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CLCN2 P51788 1/20 0.30
▸ SLC9A1 P19634 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
SCHEMBL5069743 0.79 PDE2A (0.43) NISCHPDE2APDE10AABL1AGPAT2
SCHEMBL14364369 0.74 AQP1 (0.42) NISCHPDE2APDE10AABL1AGPAT2
SCHEMBL9139591 0.70 NISCH (0.52) NISCHPDE2APDE10AABL1AGPAT2
SCHEMBL30377758 0.70 NISCH (0.52) NISCHPDE2APDE10AABL1AGPAT2
SCHEMBL10599581 0.68 CYP2A6 (0.40) NPC1RAB9ASMN1; SMN2HSD11B1TP53
SCHEMBL10094685 0.68 ABL1 (0.46) NISCHPDE2APDE10AABL1AGPAT2
SCHEMBL10607765 0.68 APP (0.47) SMN1; SMN2
SCHEMBL18772851 0.67 AGPAT2 (0.50) NISCHPDE2APDE10AABL1AGPAT2
SCHEMBL7803538 0.67 AHR (0.42) RAB9AHSD11B1TP53CYP1A2
SCHEMBL600882 0.66 — —

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
US-7365196-B2 Sulphonamido-substituted bridged bicycloalkyl derivatives MERCK SHARP & DOHME LTD. (GB) 2008-04-29 — — US disclosed
US-20040029862-A1 Sulphonamido-substituted bridged bicycloalkyl derivatives MERCK CANADA INC. (CA) 2004-02-12 — — 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-20040029862-A1 Sulphonamido-substituted bridged bicycloalkyl derivatives BACE1, BACE2, PSEN2 NISCH 4481/4885PDE2A 4581/4885PDE10A 4509/4885

“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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