SCHEMBL31376516

SCHEMBL31376516

O=C(NCc1ccccc1Cn1cncn1)c1cn(Cc2ccccc2)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.64
▸ LMNA P02545 2/20 0.54
▸ KLKB1 P03952 1/20 0.52
▸ F10 P00742 3/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC2 Q92769 1/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ PTPN7 P35236 1/20 0.48
▸ CNR1 P21554 2/20 0.48
▸ ADORA1 P30542 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ CNR2 P34972 1/20 0.45

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
SCHEMBL15363130 0.75 L3MBTL1 (0.66) LMNAKLKB1F10HDAC1HDAC2
SCHEMBL13753339 0.74 LMNA (0.70) LMNAKLKB1F10HDAC1HDAC2
SCHEMBL24273334 0.72 CNR1 (0.59) LMNAKLKB1F10HDAC1HDAC2
SCHEMBL8230799 0.72 F10 (0.84) LMNAKLKB1F10HDAC1HDAC2
SCHEMBL4920626 0.71 TAS1R3 (0.58) LMNAKLKB1F10MAPK1PTPN7
SCHEMBL13276970 0.70 F10 (0.66) LMNAKLKB1F10HDAC1HDAC2
SCHEMBL13276969 0.70 F10 (0.66) LMNAKLKB1F10HDAC1HDAC2
SCHEMBL28512721 0.70 ADORA1 (0.69) LMNAL3MBTL1MAPK1CNR1ADORA1
SCHEMBL28462852 0.70 L3MBTL1 (0.65) LMNAHDAC1HDAC2L3MBTL1MAPK1
SCHEMBL5852445 0.70 NPSR1 (0.81) LMNAL3MBTL1MAPK1CNR1ADORA1

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-20250099482-A1 TIP60 NEURO-EPIGENETIC MODULATORS DREXEL UNIVERSITY 2025-03-27 — — 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-20250099482-A1 TIP60 NEURO-EPIGENETIC MODULATORS MECP2, EP300, EHMT1 CYP19A1 4413/4885LMNA 2264/4885KLKB1 3941/4885

“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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