SCHEMBL10490107

SCHEMBL10490107

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

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.67
▸ FAP Q12884 2/20 0.67
▸ ALDH1A1 P00352 2/20 0.67
▸ USP2 O75604 1/20 0.67
▸ CYP3A4 P08684 1/20 0.67
▸ HPGD P15428 1/20 0.67
▸ PTGS1 P23219 2/20 0.67
▸ TDP1 Q9NUW8 8/20 0.58
▸ ABCC4 O15439 2/20 0.58
▸ CNR1 P21554 1/20 0.58
▸ CTDSP1 Q9GZU7 1/20 0.58
▸ NR1I2 O75469 4/20 0.53
▸ PPARG P37231 2/20 0.53
▸ ALB P02768 1/20 0.53
▸ SLC22A6 Q4U2R8 1/20 0.53
▸ SLC22A8 Q8TCC7 1/20 0.53
▸ SLC22A11 Q9NSA0 1/20 0.53
▸ APEX1 P27695 3/20 0.52
▸ HSD17B10 Q99714 3/20 0.52
▸ LMNA P02545 2/20 0.52

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
SCHEMBL10490381 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10490361 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10795144 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10490364 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10490106 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10529456 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10490376 1.00 MAPT (0.67) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10490271 0.95 TDP1 (0.61) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10797134 0.95 TDP1 (0.61) MAPTFAPALDH1A1USP2CYP3A4
SCHEMBL10490266 0.95 TDP1 (0.61) MAPTFAPALDH1A1USP2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4874856-A ANTIBIOTICS BRISTOL-MYERS COMPANY (US) 1989-10-17 — — US disclosed
EP-0304036-A2 3-(substituted)propenyl-7-(aminothiazolylacetamido)ceph-3-em-4-carboxylic acids and esters thereof Bristol-Myers Squibb Company (US) 1989-02-22 — — EP disclosed
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