SCHEMBL10465617

SCHEMBL10465617

CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOCC(=O)OC(C)(C)C)c3nc(NC=O)sc3Cl)[C@@H]2SC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 3/20 0.42
▸ APBA1 Q02410 3/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ APAF1 O14727 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ PLCG1 P19174 1/20 0.42
▸ ABCC2 Q92887 1/20 0.42
▸ SIRT5 Q9NXA8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ PSMD14 O00487 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ KMT2A Q03164 3/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ CYP2C19 P33261 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ SLC15A2 Q16348 2/20 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
SCHEMBL10465616 1.00 CACNA1B (0.42) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL10465607 0.94 TDP1 (0.42) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL10465606 0.94 TDP1 (0.42) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL10603869 0.94 TDP1 (0.42) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL10466419 0.92 TDP1 (0.41) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL10466417 0.92 TDP1 (0.41) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL9481547 0.91 TDP1 (0.53) TDP1APAF1LMNATSHRAPEX1
SCHEMBL9481554 0.91 TDP1 (0.53) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10645924 0.91 TDP1 (0.40) CACNA1BAPBA1TDP1APAF1LMNA
SCHEMBL10645127 0.90 TDP1 (0.40) TDP1APAF1LMNATSHRAPEX1

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-4925948-A CEPHALOSPORIN ANTIBIOTIC CHEMICAL INTERMEDIATES FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-05-15 — — US disclosed
EP-0055465-B1 7-ACYLAMINOCEPHALOSPORANIC ACID DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-08-23 — — EP disclosed
US-4596829-A Pharmaceuticals FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-06-24 — — US disclosed
US-4438113-A 7-Acylaminocephalosporanic acid derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-03-20 — — US disclosed
EP-0055465-A2 7-Acylaminocephalosporanic acid derivatives and processes for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-07-07 — — EP disclosed
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