SCHEMBL17177128

SCHEMBL17177128

O=C(Cc1cccnc1)Nc1nnc([C@@H]2CCCC[C@H](c3nnc(NC(=O)Cc4cccnc4)s3)C2)s1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 14/20 0.74
▸ RECQL P46063 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ CCNE1 P24864 2/20 0.52
▸ CDK2 P24941 2/20 0.52
▸ CDK5 Q00535 2/20 0.52
▸ PKM P14618 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL15725087 1.00 GLS (0.74) GLSRECQLALDH1A1MEN1KMT2A
SCHEMBL15725094 0.98 GLS (0.78) GLSRECQLALDH1A1CCNE1CDK2
SCHEMBL15725008 0.98 GLS (0.78) GLSRECQLALDH1A1CCNE1CDK2
SCHEMBL17172606 0.97 GLS (0.80) GLSRECQLALDH1A1MEN1KMT2A
SCHEMBL21325659 0.96 GLS (0.67) GLSRECQLALDH1A1MEN1KMT2A
SCHEMBL15725064 0.96 GLS (0.77) GLSMEN1KMT2APKMSMN1; SMN2
SCHEMBL17172578 0.95 GLS (0.84) GLSRECQLALDH1A1CCNE1CDK2
SCHEMBL17172609 0.95 GLS (0.84) GLSRECQLALDH1A1CCNE1CDK2
SCHEMBL17172598 0.93 GLS (0.83) GLSKMT2A
SCHEMBL16887441 0.91 GLS (0.69) GLSRECQLMEN1KMT2APKM

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-20150291576-A1 COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2015-10-15 — — 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-20150291576-A1 COMPOUNDS AND THEIR METHODS OF USE GLS, GLS2, GLUL GLS 1/4885RECQL 1267/4885ALDH1A1 196/4885

“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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