SCHEMBL19920201

SCHEMBL19920201

O=C(Nc1ncc(CCCCc2nnc(NC(=O)C3(C(F)(F)F)CC3)s2)s1)C1(C(F)(F)F)CC1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GLS O94925 18/20 0.50
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
USP21 Q9UK80 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
SCHEMBL14987267 0.89 GLS (0.56) GLSMEN1KMT2A
SCHEMBL15043787 0.78 GLS (0.57) GLS
SCHEMBL24953526 0.70 SCD (0.50) MEN1KMT2A
SCHEMBL21484176 0.69 GLS (0.82) GLS
SCHEMBL24953752 0.68 OGA (0.36)
SCHEMBL14987620 0.67 GLS (0.66) GLS
SCHEMBL14987626 0.67 GLS (1.00) GLS
SCHEMBL14987636 0.66 GLS (1.00) GLS
SCHEMBL14987281 0.65 GLS (1.00) GLSMEN1KMT2A
SCHEMBL14987635 0.65 GLS (1.00) GLSMEN1KMT2A

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-20180055825-A1 TREATMENT OF CANCER WITH INHIBITORS OF GLUTAMINASE LIANG YU (US) 2018-03-01 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-20180055825-A1 TREATMENT OF CANCER WITH INHIBITORS OF GLUTAMINASE GLS, GLS2, GLUL GLS 1/4885MEN1 2330/4885KMT2A 1141/4885

“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.