SCHEMBL9893616

SCHEMBL9893616

CCOC(=O)c1nc(-c2ccc(C)cc2)n(-c2cc(Cl)ccc2C)c1-c1cc(Cl)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
GAA P10253 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
GABRA2 P47869 7/20 0.48
GABRB2 P47870 7/20 0.48
MDM2 Q00987 2/20 0.48
POLB P06746 1/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 1/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA1 P14867 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA4 P48169 1/20 0.41
GABRA6 Q16445 1/20 0.41
TARBP2 Q15633 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL1437158 0.93 MDM2 (0.47) MAPTGAANPSR1GPR55GABRA2
SCHEMBL9894027 0.92 MDM2 (0.58) MAPTNPSR1GABRA2GABRB2MDM2
SCHEMBL9893799 0.92 MDM2 (0.60) MAPTGAANPSR1GPR55GABRA2
SCHEMBL9893781 0.90 MDM2 (0.60) MAPTGAANPSR1GPR55MDM2
SCHEMBL1437376 0.85 MDM2 (0.45) MAPTGAANPSR1GPR55GABRA2
SCHEMBL1438083 0.84 MDM2 (0.44) MAPTGABRA2GABRB2MDM2POLB
SCHEMBL9893673 0.84 MDM2 (0.69) MAPTGAANPSR1GPR55GABRA2
SCHEMBL1437239 0.84 GABRA2 (0.39) MAPTGAANPSR1GPR55GABRA2
SCHEMBL1437262 0.83 MDM2 (0.59) MDM2POLBTP53
SCHEMBL9894293 0.83 MDM2 (0.49) MAPTGAANPSR1GPR55GABRA2

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 MAPT 582/4885GAA 2555/4885NPSR1 2431/4885

“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.