SCHEMBL3701993

SCHEMBL3701993

O=C(O)CC1C(=O)N(C(Cl)Cc2ccc(Cl)cc2)CC(=O)N1CCc1cccs1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
TP53 P04637 2/20 0.38
KMT2A Q03164 6/20 0.38
MEN1 O00255 5/20 0.38
ADAM17 P78536 1/20 0.38
MC4R P32245 5/20 0.37
ALDH1A1 P00352 4/20 0.36
GAA P10253 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34

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
SCHEMBL3707295 0.90 MAPT (0.42) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL9103782 0.90 MAPT (0.48) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL3699317 0.90 MAPT (0.44) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL9105309 0.89 MAPT (0.47) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL9107165 0.89 MAPT (0.47) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL3694999 0.89 MAPT (0.49) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL3694901 0.88 MAPT (0.47) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL9107477 0.88 MAPT (0.49) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL9108290 0.86 MAPT (0.45) MAPTTP53KMT2AMEN1ADAM17
SCHEMBL3704317 0.86 MAPT (0.40) MAPTTP53KMT2AMEN1ADAM17

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-9040701-B2 Apaf-1 inhibitor compounds LABORATORIOS SALVAT, S.A. (ES) 2015-05-26 US disclosed
EP-2460798-A2 APAF-1 INHIBITOR COMPOUNDS Laboratorios SALVAT, S.A. (ES) 2012-06-06 EP disclosed
US-20120122868-A1 APAF-1 INHIBITOR COMPOUNDS LABORATORIOS SALVAT, S.A. (ES) 2012-05-17 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-20120122868-A1 APAF-1 INHIBITOR COMPOUNDS APAF1, API5, AIFM1 MAPT 4448/4885TP53 336/4885KMT2A 4192/4885

“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.