SCHEMBL15215128

SCHEMBL15215128

CNc1c(C(N)=O)c(C)nc2cc(C)ccc12

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 7/20 0.47
▸ ALDH1A1 P00352 3/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ LRRK2 Q5S007 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ DHODH Q02127 1/20 0.37

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
SCHEMBL15215122 0.87 GRM2 (0.46) GRM2ALDH1A1KMT2AKDM4EMEN1
SCHEMBL15215129 0.86 ALDH1A1 (0.46) ALDH1A1KMT2AKDM4EMEN1LRRK2
SCHEMBL15215104 0.74 CSF1R (0.58) LRRK2
SCHEMBL15215121 0.72 MPO (0.40) ALDH1A1KDM4ELRRK2
SCHEMBL31673858 0.69 KDM1A (0.54) KMT2AKDM4EMEN1LMNAMAPT
SCHEMBL23629059 0.68 CSF1R (0.53) ALDH1A1KMT2AKDM4EMEN1LRRK2
SCHEMBL15215111 0.67 CSF1R (0.47) ALDH1A1KMT2AKDM4EMEN1MAPT
SCHEMBL31673741 0.67 LIMK1 (0.46) GRM2ALDH1A1KMT2AKDM4EMEN1
SCHEMBL27642254 0.66 GRM2 (0.65) GRM2ALDH1A1
SCHEMBL27623216 0.66 GRM2 (0.69) GRM2LMNADHODH

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-20130225524-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2013-08-29 — — 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-20130225524-A1 Chemical Compounds LDHA, NQO2, LDHB GRM2 3531/4885ALDH1A1 33/4885KMT2A 968/4885

“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.

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