SCHEMBL9926518

SCHEMBL9926518

Cc1cc(Cl)ccc1CC(=O)NCc1cccnc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.57
TDP1 Q9NUW8 1/20 0.55
GAA P10253 1/20 0.55
NAMPT P43490 1/20 0.55
ANO1 Q5XXA6 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
ERCC1 P07992 1/20 0.53
ERCC4 Q92889 1/20 0.53
NOTUM Q6P988 1/20 0.53
POLB P06746 2/20 0.53
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL9926533 0.85 SMN1; SMN2 (0.66) NPC1TDP1GAANAMPTANO1
SCHEMBL9926520 0.84 MEN1 (0.55) NPC1LMNAMAPTKMT2AMEN1
SCHEMBL9926569 0.79 PYGL (0.52) NAMPTLMNAERCC1ERCC4HTT
SCHEMBL9926519 0.77 POLB (0.58) NPC1ANO1MAPTKMT2AMEN1
SCHEMBL22307433 0.76 GAA (0.66) GAANAMPTLMNAMAPTKMT2A
SCHEMBL30172092 0.76 LMNA (0.86) GAALMNAMAPTKMT2AERCC1
SCHEMBL28497414 0.76 LMNA (0.86) GAALMNAMAPTKMT2AERCC1
SCHEMBL9926561 0.75 KMT2A (0.65) NPC1ANO1KMT2AMEN1ERCC1
SCHEMBL31207025 0.75 GAA (0.57) GAALMNAMAPTKMT2AMEN1
SCHEMBL31321081 0.74 MAPT (0.69) GAALMNAMAPTKMT2ANOTUM

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-20120149661-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS NOVARTIS AG (CH) 2012-06-14 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-20120149661-A1 TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS MDM4, MDM2, TP53 NPC1 3324/4885TDP1 389/4885GAA 2555/4885

“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.