SCHEMBL1250538

SCHEMBL1250538

Cc1ccc(NC(=O)c2ccc3nc(-c4ccccc4Cl)n(CCO)c3c2)cc1C

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACSS2 Q9NR19 7/20 0.49
▸ PDE2A O00408 6/20 0.46
▸ PDE10A Q9Y233 4/20 0.46
▸ ESR2 Q92731 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ MCHR1 Q99705 1/20 0.44
▸ DGAT1 O75907 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL1248717 0.90 DGAT1 (0.48) ACSS2PDE2ANPC1RAB9AKMT2A
SCHEMBL1250473 0.88 ESR2 (0.49) PDE2APDE10AESR2NPC1RAB9A
SCHEMBL1249228 0.85 RAB9A (0.48) ACSS2NPC1RAB9AKMT2AMCHR1
SCHEMBL1249330 0.85 DGAT1 (0.56) ACSS2NPC1RAB9AKMT2ADGAT1
SCHEMBL1250558 0.83 MAPT (0.46) ACSS2NPC1RAB9AKMT2ADGAT1
SCHEMBL3171773 0.81 PTGER4 (0.48) ACSS2PDE2APDE10AESR2KMT2A
SCHEMBL1249925 0.81 DGAT1 (0.47) ACSS2NPC1RAB9AKMT2ADGAT1
SCHEMBL1250370 0.79 DGAT1 (0.53) PDE2ANPC1RAB9AKMT2ADGAT1
SCHEMBL1248696 0.73 PRSS12 (0.60) NPC1RAB9AKMT2ADGAT1SMN1; SMN2
SCHEMBL1250280 0.73 DGAT1 (0.61) NPC1RAB9AKMT2ADGAT1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 — — US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 — — US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 — — 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-20110046133-A1 ORGANIC COMPOUNDS DGAT1, DGAT2, SOAT1 ACSS2 128/4885PDE2A 2882/4885PDE10A 3211/4885

“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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