SCHEMBL9926585

SCHEMBL9926585

Cc1cc(Cl)ccc1CC(=O)NCCN(C)C

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.50
HRH4 Q9H3N8 2/20 0.47
HRH3 Q9Y5N1 2/20 0.47
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 1/20 0.45
HPGD P15428 2/20 0.44
NPSR1 Q6W5P4 2/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 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
SCHEMBL9926532 0.78 HTT (0.54) P2RX7ALDH1A1SMN1; SMN2HTTHPGD
SCHEMBL9926646 0.78 P2RX7 (0.48) P2RX7HTTHPGDNPSR1KMT2A
SCHEMBL2276151 0.78 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2HPGDKMT2ALMNA
SCHEMBL9926586 0.77 HPGD (0.50) P2RX7ALDH1A1SMN1; SMN2HTTHPGD
SCHEMBL9926464 0.77 P2RX7 (0.51) P2RX7POLB
SCHEMBL9926520 0.76 MEN1 (0.55) P2RX7ALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL9926514 0.76 CNR1 (0.54) P2RX7SMN1; SMN2KMT2ALMNAPOLB
SCHEMBL8651253 0.75 P2RX7 (0.50) P2RX7ALDH1A1HPGDKMT2A
SCHEMBL23565221 0.75 P2RX7 (0.59) P2RX7ALDH1A1SMN1; SMN2HTT
SCHEMBL9926531 0.75 ANO1 (0.51) P2RX7ALDH1A1HTTPOLB

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 P2RX7 3259/4885HRH4 118/4885HRH3 479/4885

“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.