SCHEMBL9893680

SCHEMBL9893680

N#Cc1nc(-c2ccsc2)n(-c2cccc(Cl)c2F)c1-c1ccc(F)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 7/20 0.52
TDP2 O95551 1/20 0.35
RET P07949 3/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2B Q13224 2/20 0.32
P2RX7 Q99572 1/20 0.32
MET P08581 1/20 0.32
IDO1 P14902 1/20 0.31
KAT2B Q92831 1/20 0.31
RXRA P19793 1/20 0.31
TGFBR1 P36897 2/20 0.31
NOTUM Q6P988 1/20 0.31

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
SCHEMBL9894537 0.86 MDM2 (0.68) MDM2GRIN1GRIN2BNOTUM
SCHEMBL1438308 0.82 MDM2 (0.52) MDM2GRIN1GRIN2BRXRATGFBR1
SCHEMBL9893845 0.81 MDM2 (0.79) MDM2NOTUM
SCHEMBL9894004 0.81 MDM2 (0.67) MDM2TDP2NOTUM
SCHEMBL1443242 0.81 MDM2 (0.52) MDM2GRIN1GRIN2BMETTGFBR1
SCHEMBL27862822 0.80 MDM2 (0.52) MDM2TDP2PDGFRBPDGFRAP2RX7
SCHEMBL1437257 0.79 MDM2 (0.65) MDM2TDP2GRIN1GRIN2BP2RX7
SCHEMBL9893656 0.79 MDM2 (0.63) MDM2TDP2NOTUM
SCHEMBL1437227 0.79 MDM2 (0.67) MDM2NOTUM
SCHEMBL1436911 0.79 MDM2 (0.64) MDM2TDP2P2RX7NOTUM

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 2/4885TDP2 948/4885RET 1167/4885

“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.