SCHEMBL5971058

SCHEMBL5971058

CCOC(=O)OC/C(C)=C/c1cccc(C#N)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 1/20 0.62
▸ CD274 Q9NZQ7 1/20 0.62
▸ MAPT P10636 1/20 0.44
▸ FBP1 P09467 2/20 0.43
▸ GRM5 P41594 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ P4HB P07237 8/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ GLO1 Q04760 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 1/20 0.38

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
SCHEMBL5971061 1.00 PDCD1 (0.62) PDCD1CD274MAPTFBP1GRM5
SCHEMBL5970509 0.81 PDCD1 (0.54) PDCD1CD274MAPTFBP1ALDH1A1
SCHEMBL7417299 0.81 PDCD1 (0.74) PDCD1CD274MAPTFBP1GRM5
SCHEMBL10848993 0.79 PDCD1 (0.71) PDCD1CD274MAPTFBP1GRM5
SCHEMBL10375509 0.79 PDCD1 (0.71) PDCD1CD274MAPTFBP1GRM5
SCHEMBL5970550 0.79 PDCD1 (0.57) PDCD1CD274FBP1GRM5CYP1A2
SCHEMBL5970556 0.79 PDCD1 (0.57) PDCD1CD274FBP1GRM5CYP1A2
SCHEMBL21457292 0.77 PDCD1 (1.00) PDCD1CD274MAPTALDH1A1KMT2A
SCHEMBL21457289 0.77 PDCD1 (1.00) PDCD1CD274MAPTALDH1A1KMT2A
SCHEMBL5970912 0.75 PDCD1 (0.51) PDCD1CD274FBP1P4HB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1245564-B1 BENZAMIDINE DERIVATIVES SANKYO CO (JP) 2006-04-05 — — EP disclosed
US-20040010009-A1 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-15 — — US disclosed
EP-1245564-A1 BENZAMIDINE DERIVATIVES Sankyo Company, Limited (JP) 2002-10-02 — — EP 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-20040010009-A1 Benzamidine derivatives HABP2, F7, F2 PDCD1 3406/4885CD274 4342/4885MAPT 4879/4885

“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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