SCHEMBL15467764

SCHEMBL15467764

C/C(=N\CC#Cc1cccc(C=O)n1)c1cccc(C)n1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 16/20 0.37
HSP90AA1 P07900 1/20 0.36
P2RX7 Q99572 1/20 0.35
TERT O14746 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
SCHEMBL877469 0.83 GRM5 (0.41) GRM5HSP90AA1
SCHEMBL25607687 0.71 GRM5 (0.36) GRM5TERT
SCHEMBL882690 0.67 GRM5 (0.43) GRM5P2RX7
SCHEMBL22354970 0.67 GRM5 (0.43) GRM5TERT
SCHEMBL874316 0.67 HSP90AA1 (0.35) GRM5HSP90AA1P2RX7TERT
SCHEMBL29951696 0.67
SCHEMBL230251 0.67
SCHEMBL877572 0.66 GRM5 (0.46) GRM5HSP90AA1
Alcohol SCHEMBL16679847 0.66 MEN1 (0.46) GRM5P2RX7TERT
SCHEMBL4562028 0.65 GRM5 (0.46) GRM5

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-20140045873-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-02-13 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-20140045873-A1 NOVEL MICROBIOCIDES MSR1, CD209, C3AR1 GRM5 1821/4885HSP90AA1 1228/4885P2RX7 627/4885

“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.