SCHEMBL9893712

SCHEMBL9893712

N#Cc1nc(-c2ccccc2)n(-c2cccc(Cl)c2F)c1-c1cc(Cl)ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 7/20 0.55
BIRC5 O15392 1/20 0.39
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38
HPGD P15428 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 2/20 0.37
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
EGFR P00533 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
NOTUM Q6P988 1/20 0.35
HTT P42858 1/20 0.35
CNR1 P21554 1/20 0.34
POLB P06746 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
SCHEMBL9894216 0.85 MDM2 (0.50) MDM2HPGDTP53
SCHEMBL1437227 0.85 MDM2 (0.67) MDM2HPGDLMNAALOX15SMN1; SMN2
SCHEMBL9893756 0.84 MDM2 (0.75) MDM2MAPTMEN1HPGDKMT2A
SCHEMBL9894537 0.82 MDM2 (0.68) MDM2SMN1; SMN2NOTUM
SCHEMBL9893843 0.82 MAPT (0.44) MDM2MAPTMEN1HPGDKMT2A
SCHEMBL1437285 0.81 MDM2 (0.46) MDM2MAPTLMNAMAPK1TDP1
SCHEMBL27879142 0.80 CNR1 (0.36) MDM2MAPTMEN1HPGDKMT2A
SCHEMBL9894425 0.79 MDM2 (0.43) MDM2MAPTHPGDLMNAALOX15
SCHEMBL9893700 0.79 MDM2 (0.59) MDM2MAPTLMNANPSR1
SCHEMBL27879143 0.77 HPGD (0.36) MDM2MAPTMEN1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102574785-A Tetra-substituted heteroaryl compounds and their use as MDM2 and/or MDM4 modulators NOVARTIS AG 2012-07-11 CN disclosed
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 MDM2 2/4885BIRC5 322/4885MAPT 582/4885

“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.