SCHEMBL31043987

SCHEMBL31043987

COc1cc(C(=O)NCc2ccc(NC(=O)OCc3ccc(Cl)cc3)cc2)n(C)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAPT P10636 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ GALR3 O60755 1/20 0.43
▸ NR2F2 P24468 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ SCD O00767 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ DHODH Q02127 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
SCHEMBL31043936 0.88 MAPT (0.49) L3MBTL1MAPTSMN1; SMN2LMNAKMT2A
SCHEMBL31043874 0.86 L3MBTL1 (0.44) L3MBTL1MAPTSMN1; SMN2LMNAKMT2A
SCHEMBL31029072 0.85 PHGDH (0.44) MAPTSMN1; SMN2NPSR1GAASCD
SCHEMBL31044020 0.85 PHGDH (0.44) MAPTSMN1; SMN2NPSR1GAASCD
SCHEMBL31044019 0.85 SMN1; SMN2 (0.43) L3MBTL1MAPTSMN1; SMN2LMNAKMT2A
SCHEMBL31043835 0.83 SMN1; SMN2 (0.42) MAPTSMN1; SMN2LMNAKMT2ARAB9A
SCHEMBL31043762 0.82 RAB9A (0.60) L3MBTL1MAPTSMN1; SMN2LMNAKMT2A
SCHEMBL31043769 0.78 KMT2A (0.61) L3MBTL1MAPTSMN1; SMN2LMNAKMT2A
SCHEMBL31043554 0.78 EPHX2 (0.54) L3MBTL1MAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL31043578 0.78 NPC1 (0.45) MAPTSMN1; SMN2LMNAKMT2AGALR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240279215-A1 NAMPT MODULATORS CYTOKINETICS, INCORPORATED 2024-08-22 — — 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-20240279215-A1 NAMPT MODULATORS NAMPT, SIRT1, NNT L3MBTL1 4526/4885MAPT 766/4885SMN1; SMN2 1882/4885

“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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