SCHEMBL10678864

SCHEMBL10678864

COCC1=C(C(=O)O)N2C(=O)C(NC(=O)/C(=N\OCC(=O)O)c3cscn3)[C@H]2SC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.67
▸ HTR2C P28335 1/20 0.67
▸ MAPT P10636 3/20 0.58
▸ PPARG P37231 2/20 0.58
▸ SLC22A6 Q4U2R8 2/20 0.58
▸ SLC22A8 Q8TCC7 2/20 0.58
▸ SLC22A11 Q9NSA0 2/20 0.58
▸ ALB P02768 1/20 0.58
▸ TDP1 Q9NUW8 7/20 0.57
▸ APEX1 P27695 3/20 0.57
▸ APAF1 O14727 2/20 0.57
▸ TSHR P16473 2/20 0.57
▸ LMNA P02545 2/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.57
▸ PLCG1 P19174 1/20 0.57
▸ ABCC2 Q92887 1/20 0.57
▸ SIRT5 Q9NXA8 1/20 0.57
▸ PSMD14 O00487 1/20 0.56
▸ MMP2 P08253 1/20 0.56
▸ PGR P06401 3/20 0.51

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
SCHEMBL10678869 1.00 NR1I2 (0.67) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10676259 0.92 NR1I2 (0.67) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10673263 0.91 NR1I2 (0.62) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10673255 0.91 NR1I2 (0.62) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL11160973 0.91 NR1I2 (0.62) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10673948 0.90 TDP1 (0.56) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10937778 0.90 TDP1 (0.58) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10673946 0.90 TDP1 (0.56) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10937785 0.90 TDP1 (0.58) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10670048 0.90 TDP1 (0.57) NR1I2HTR2CMAPTPPARGSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4649136-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 — — US claimed
EP-0071891-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-03 — — EP claimed
EP-0071891-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP claimed
US-4736039-A ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-04-05 — — US disclosed
US-4649136-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 — — US disclosed
EP-0071891-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-03 — — EP disclosed
US-4515788-A BACTERICIDAL ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-05-07 — — US disclosed
EP-0071891-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP disclosed
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