SCHEMBL10490346

SCHEMBL10490346

C/C=C\C1=C(C(=O)OCOC(=O)C(C)(C)C)N2C(=O)[C@@H](NC(=O)/C(=N\OC(C)=O)c3csc(N)n3)[C@H]2SC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.71
▸ FAP Q12884 2/20 0.71
▸ ALDH1A1 P00352 2/20 0.71
▸ PTGS1 P23219 2/20 0.71
▸ USP2 O75604 1/20 0.71
▸ CYP3A4 P08684 1/20 0.71
▸ HPGD P15428 1/20 0.71
▸ NR1I2 O75469 5/20 0.56
▸ PPARG P37231 2/20 0.56
▸ ALB P02768 1/20 0.56
▸ SLC22A6 Q4U2R8 1/20 0.56
▸ SLC22A8 Q8TCC7 1/20 0.56
▸ SLC22A11 Q9NSA0 1/20 0.56
▸ TDP1 Q9NUW8 8/20 0.54
▸ APEX1 P27695 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ APAF1 O14727 2/20 0.54
▸ TSHR P16473 1/20 0.54
▸ PLCG1 P19174 1/20 0.54

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
SCHEMBL10490375 1.00 MAPT (0.71) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10490350 1.00 MAPT (0.71) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10490369 1.00 MAPT (0.71) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10490138 0.95 MAPT (0.63) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10490136 0.95 MAPT (0.63) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10490162 0.95 MAPT (0.63) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10490166 0.95 MAPT (0.63) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10794220 0.93 PTGS1 (0.82) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10798727 0.93 PTGS1 (0.82) MAPTFAPALDH1A1PTGS1USP2
SCHEMBL10793827 0.93 PTGS1 (0.82) MAPTFAPALDH1A1PTGS1USP2

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
US-4708955-A ANTIBACTERIALS BRISTOL-MYERS COMPANY (US) 1987-11-24 — — US claimed
US-4874856-A ANTIBIOTICS BRISTOL-MYERS COMPANY (US) 1989-10-17 — — US disclosed
US-4708955-A ANTIBACTERIALS BRISTOL-MYERS COMPANY (US) 1987-11-24 — — US disclosed
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