SCHEMBL1249925

SCHEMBL1249925

COc1cccc(OC)c1-c1nc2ccc(C(=O)Nc3ccc(C)c(C)c3)cc2n1CCO

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 4/20 0.47
▸ ACSS2 Q9NR19 6/20 0.46
▸ MAPT P10636 4/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ POLB P06746 2/20 0.44
▸ PIN1 Q13526 1/20 0.43
▸ RAB9A P51151 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ IMPDH2 P12268 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TP53 P04637 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 0.90 DGAT1 (0.56) DGAT1ACSS2MAPTSMN1; SMN2RAB9A
SCHEMBL1251403 0.88 DGAT1 (0.51) DGAT1MAPTSMN1; SMN2POLBRAB9A
SCHEMBL1248717 0.87 DGAT1 (0.48) DGAT1ACSS2MAPTSMN1; SMN2POLB
SCHEMBL3171231 0.82 PTGER4 (0.48) ACSS2MAPTPIN1
SCHEMBL1250538 0.81 ACSS2 (0.49) DGAT1ACSS2SMN1; SMN2POLBRAB9A
SCHEMBL1250558 0.81 MAPT (0.46) DGAT1ACSS2MAPTSMN1; SMN2POLB
SCHEMBL1249228 0.80 RAB9A (0.48) DGAT1ACSS2MAPTSMN1; SMN2PIN1
SCHEMBL1250280 0.76 DGAT1 (0.61) DGAT1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL1250370 0.74 DGAT1 (0.53) DGAT1MAPTSMN1; SMN2POLBRAB9A
SCHEMBL3167934 0.72 PTGER4 (0.49) ACSS2PIN1

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 128/4885MAPT 1210/4885

“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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