SCHEMBL18960804

SCHEMBL18960804

CCOC(=N)c1csc(Cn2ccn3nccc23)c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.33
▸ DAO P14920 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
Hydrochloric Acid SCHEMBL18939042 0.99 DGAT1 (0.33) DGAT1DAOTP53RAB9A
SCHEMBL18939133 0.82 ITGB3 (0.32) —
SCHEMBL18960799 0.81 DGAT1 (0.42) DGAT1TP53
Hydrochloric Acid SCHEMBL18939008 0.80 DGAT1 (0.41) DGAT1TP53
SCHEMBL18938989 0.79 TP53 (0.32) DAOTP53RAB9A
Hydrochloric Acid SCHEMBL28658579 0.76 TNIK (0.35) DAOTP53RAB9A
SCHEMBL28658267 0.75 DAO (0.32) DAO
Hydrochloric Acid SCHEMBL18939177 0.74 KDR (0.38) DGAT1
SCHEMBL9299345 0.67 ALDH1A1 (0.43) —
SCHEMBL18960806 0.65 PDE4D (0.38) —

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE48097-E1 Cephem compounds, their production and use NAEJA-RGM PHARMACEUTICALS ULC (CA) 2020-07-14 — — US disclosed
US-9751894-B2 Cephem compounds, their production and use NAEJA-RGM PHARMACEUTICALS INC. (CA) 2017-09-05 — — US disclosed
US-9751894-B2 Cephem compounds, their production and use NAEJA-RGM PHARMACEUTICALS INC. (CA) 2017-09-05 — — US disclosed
US-20170166587-A1 CEPHEM COMPOUNDS, THEIR PRODUCTION AND USE NAEJA-RGM PHARMACEUTICALS ULC (CA) 2017-06-15 — — US disclosed
US-20170166587-A1 CEPHEM COMPOUNDS, THEIR PRODUCTION AND USE NAEJA-RGM PHARMACEUTICALS ULC (CA) 2017-06-15 — — 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-20170166587-A1 CEPHEM COMPOUNDS, THEIR PRODUCTION AND USE CEP170, AADAC, NAA50 DGAT1 4394/4885DAO 127/4885TP53 1406/4885

“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.

Send feedback