SCHEMBL12335350

SCHEMBL12335350

O=C(NCc1cccnc1)Nc1ccc(COc2ccc(F)cc2-c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 15/20 0.57
▸ LMNA P02545 1/20 0.57
▸ CYP11B1 P15538 1/20 0.56
▸ CYP11B2 P19099 1/20 0.56
▸ LRRK2 Q5S007 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ POLB P06746 1/20 0.53

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
SCHEMBL12336109 0.95 NAMPT (0.59) NAMPTLMNAL3MBTL1POLB
SCHEMBL12335322 0.93 CYP11B1 (0.63) NAMPTLMNACYP11B1CYP11B2LRRK2
SCHEMBL12335060 0.91 NAMPT (0.58) NAMPTCYP11B1CYP11B2L3MBTL1POLB
SCHEMBL12335447 0.91 NAMPT (0.62) NAMPTCYP11B1CYP11B2POLB
SCHEMBL12336096 0.90 LMNA (0.61) NAMPTLMNACYP11B1CYP11B2L3MBTL1
SCHEMBL12336101 0.90 LRRK2 (0.59) NAMPTLRRK2L3MBTL1POLB
SCHEMBL12336078 0.90 NAMPT (0.61) NAMPTLMNACYP11B1CYP11B2POLB
SCHEMBL12335054 0.89 NAMPT (0.59) NAMPTLRRK2L3MBTL1
SCHEMBL12335344 0.88 NAMPT (0.61) NAMPTCYP11B1CYP11B2L3MBTL1POLB
SCHEMBL12334608 0.88 POLB (0.60) NAMPTLMNACYP11B1CYP11B2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160367541-A1 THERAPEUTIC AND DIAGNOSTIC METHODS ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2016-12-22 — — US disclosed
US-20160367541-A1 THERAPEUTIC AND DIAGNOSTIC METHODS ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2016-12-22 — — US disclosed
US-20150353538-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2015-12-10 — — US disclosed
US-8912184-B1 Therapeutic and diagnostic methods ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2014-12-16 — — US disclosed
US-8912184-B1 Therapeutic and diagnostic methods ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2014-12-16 — — US disclosed
WO-2011109441-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2011-09-09 — — WO 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 (2 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-20160367541-A1 THERAPEUTIC AND DIAGNOSTIC METHODS NAMPT, NAPRT, NNT NAMPT 1/4885LMNA 1146/4885CYP11B1 2221/4885
US-20150353538-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF NFATC1, CD47, CD4 NAMPT 596/4885LMNA 4409/4885CYP11B1 770/4885

“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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