SCHEMBL11305196

SCHEMBL11305196

O=C(O)C1=C(Cl)CS[C@H]2C(NC(=O)C(O)c3ccccc3)C(=O)N12

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.79
▸ HSD17B10 Q99714 7/20 0.79
▸ MAPT P10636 6/20 0.79
▸ KDM4E B2RXH2 5/20 0.79
▸ TDP1 Q9NUW8 5/20 0.79
▸ KMT2A Q03164 4/20 0.79
▸ HPGD P15428 4/20 0.79
▸ CYP3A4 P08684 4/20 0.79
▸ SLC15A2 Q16348 3/20 0.79
▸ MEN1 O00255 2/20 0.79
▸ CYP2C9 P11712 2/20 0.79
▸ NR1I2 O75469 2/20 0.79
▸ ADORA3 P0DMS8 1/20 0.79
▸ CTDSP1 Q9GZU7 1/20 0.79
▸ LMNA P02545 1/20 0.79
▸ HIF1A Q16665 1/20 0.79
▸ BLM P54132 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ ADRA1A P35348 1/20 0.60

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
Cefaclor Anhydrous SCHEMBL16072812 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL8626208 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL8478823 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL6155629 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL8524989 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL8943624 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL1006419 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL33540 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
Cefaclor Anhydrous SCHEMBL8626211 0.88 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTKDM4ETDP1
SCHEMBL11302496 0.88 ALDH1A1 (0.77) ALDH1A1HSD17B10MAPTKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4281116-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1981-07-28 — — US disclosed
US-4260745-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1981-04-07 — — US disclosed
US-4252950-A ANTIBIOTICS, BACTERICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1981-02-24 — — US disclosed
US-4208515-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1980-06-17 — — US disclosed
US-4064343-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1977-12-20 — — US disclosed
US-3992377-A 3-Thio-substituted cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1976-11-16 — — US disclosed
US-3962227-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1976-06-08 — — US disclosed
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