SCHEMBL9893687

SCHEMBL9893687

Cc1cccc(C(=N)Nc2cc(Cl)ccc2C)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 3/20 0.47
KCNK3 O14649 2/20 0.46
KCNK9 Q9NPC2 1/20 0.46
TRPV1 Q8NER1 1/20 0.45
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
HTT P42858 3/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43

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
SCHEMBL1437236 0.87 KMT2A (0.45) GAASMN1; SMN2MAPTKCNK3KCNK9
SCHEMBL1437599 0.86 GAA (0.50) GAASMN1; SMN2MAPTTRPV1KDM4E
SCHEMBL1436924 0.83 GAA (0.50) GAASMN1; SMN2MAPTKDM4EPOLB
SCHEMBL1437427 0.83 GAA (0.50) GAASMN1; SMN2MAPTKDM4EPOLB
SCHEMBL20052984 0.81 KMT2A (0.54) GAASMN1; SMN2KCNK3KCNK9POLB
SCHEMBL1437752 0.79 KCNMA1 (0.52) GAAMAPTHTTLMNAALDH1A1
SCHEMBL1437643 0.74 MAPT (0.47) GAAMAPTTRPV1KDM4EPOLB
SCHEMBL28810353 0.74 NOX1 (0.53) SMN1; SMN2MAPTPOLBHTTLMNA
SCHEMBL14516182 0.73 GAA (0.60) GAASMN1; SMN2MAPTKDM4EPOLB
SCHEMBL1437117 0.71 MAPT (0.52) GAASMN1; SMN2MAPTHTTLMNA

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 GAA 2555/4885SMN1; SMN2 886/4885MAPT 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.