SCHEMBL10354060

SCHEMBL10354060

CO/N=C(/C(=O)NC1C(=O)N2C(C(=O)O)=C(/C=C/c3scnc3Cl)CS[C@H]12)c1csc(N)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.68
▸ ALDH1A1 P00352 2/20 0.68
▸ USP2 O75604 1/20 0.68
▸ CYP3A4 P08684 1/20 0.68
▸ HPGD P15428 1/20 0.68
▸ FAP Q12884 1/20 0.68
▸ NR1I2 O75469 5/20 0.65
▸ HTR2C P28335 1/20 0.65
▸ PPARG P37231 2/20 0.63
▸ SLC22A6 Q4U2R8 2/20 0.63
▸ SLC22A8 Q8TCC7 2/20 0.63
▸ SLC22A11 Q9NSA0 2/20 0.63
▸ ALB P02768 1/20 0.63
▸ TDP1 Q9NUW8 6/20 0.62
▸ APEX1 P27695 3/20 0.62
▸ APAF1 O14727 2/20 0.62
▸ LMNA P02545 2/20 0.62
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ TSHR P16473 1/20 0.62
▸ PLCG1 P19174 1/20 0.62

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
SCHEMBL10354256 1.00 MAPT (0.68) MAPTALDH1A1USP2CYP3A4HPGD
SCHEMBL10354062 1.00 MAPT (0.68) MAPTALDH1A1USP2CYP3A4HPGD
SCHEMBL10354068 0.99 MAPT (0.67) MAPTALDH1A1USP2CYP3A4HPGD
SCHEMBL10354072 0.93 MAPT (0.67) MAPTALDH1A1USP2CYP3A4HPGD
Cefditoren SCHEMBL37473 0.92 MAPT (0.79) MAPTALDH1A1USP2CYP3A4HPGD
Cefditoren SCHEMBL13986532 0.92 MAPT (0.79) MAPTALDH1A1USP2CYP3A4HPGD
Cefditoren SCHEMBL2925672 0.92 MAPT (0.79) MAPTALDH1A1USP2CYP3A4HPGD
Cefditoren SCHEMBL183494 0.92 MAPT (0.79) MAPTALDH1A1USP2CYP3A4HPGD
Cefditoren SCHEMBL1650584 0.92 MAPT (0.79) MAPTALDH1A1USP2CYP3A4HPGD
Cefditoren SCHEMBL157719 0.92 MAPT (0.79) MAPTALDH1A1USP2CYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0175610-A2 New cephalosporin compounds and the production thereof MEIJI SEIKA KAISHA LTD. (JP) 1986-03-26 — — EP claimed
EP-0175610-B1 NEW CEPHALOSPORIN COMPOUNDS AND THE PRODUCTION THEREOF MEIJI SEIKA KAISHA LTD. (JP) 1990-08-29 — — EP disclosed
US-4839350-A Cephalosporin compounds and the production thereof MEIJI SEIKA KAISHA, LTD. (JP) 1989-06-13 — — US disclosed
EP-0175610-A2 New cephalosporin compounds and the production thereof MEIJI SEIKA KAISHA LTD. (JP) 1986-03-26 — — EP disclosed
Send feedback