SCHEMBL1248717

SCHEMBL1248717

Cc1ccc(NC(=O)c2ccc3nc(-c4c(Cl)cccc4Cl)n(CCO)c3c2)cc1C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 5/20 0.48
▸ ACSS2 Q9NR19 6/20 0.47
▸ PDE2A O00408 1/20 0.45
▸ NPC1 O15118 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ POLB P06746 1/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ CSF1R P07333 1/20 0.42
▸ KCNQ3 O43525 1/20 0.42
▸ KCNQ2 O43526 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL1249330 0.91 DGAT1 (0.56) DGAT1ACSS2NPC1RAB9ASMN1; SMN2
SCHEMBL1250558 0.91 MAPT (0.46) DGAT1ACSS2NPC1RAB9ASMN1; SMN2
SCHEMBL1250538 0.90 ACSS2 (0.49) DGAT1ACSS2PDE2ANPC1RAB9A
SCHEMBL1250370 0.87 DGAT1 (0.53) DGAT1PDE2ANPC1RAB9ASMN1; SMN2
SCHEMBL1249925 0.87 DGAT1 (0.47) DGAT1ACSS2NPC1RAB9ASMN1; SMN2
SCHEMBL1249228 0.86 RAB9A (0.48) DGAT1ACSS2NPC1RAB9ASMN1; SMN2
SCHEMBL1251371 0.81 NPC1 (0.54) DGAT1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL3168338 0.81 NR1H4 (0.49) ACSS2PDE2A
SCHEMBL1250473 0.79 ESR2 (0.49) DGAT1PDE2ANPC1RAB9ASMN1; SMN2
SCHEMBL1250959 0.78 MAPT (0.49) DGAT1NPC1RAB9ASMN1; SMN2POLB

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 DGAT1 1/4885ACSS2 128/4885PDE2A 2882/4885

“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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