SCHEMBL9364352

SCHEMBL9364352

N#CCSC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)/C(=N\O)c3csc(N)n3)[C@H]2SC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 0.67
▸ MAPT P10636 4/20 0.67
▸ ABCC4 O15439 3/20 0.67
▸ CNR1 P21554 1/20 0.67
▸ CTDSP1 Q9GZU7 1/20 0.67
▸ NR1I2 O75469 5/20 0.59
▸ HTR2C P28335 1/20 0.59
▸ APAF1 O14727 2/20 0.57
▸ PSMD14 O00487 1/20 0.57
▸ MMP2 P08253 1/20 0.57
▸ APEX1 P27695 3/20 0.56
▸ LMNA P02545 2/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ TSHR P16473 1/20 0.56
▸ PLCG1 P19174 1/20 0.56
▸ ABCC2 Q92887 1/20 0.56
▸ SIRT5 Q9NXA8 1/20 0.56
▸ PPARG P37231 2/20 0.55
▸ SLC22A6 Q4U2R8 2/20 0.55
▸ SLC22A8 Q8TCC7 2/20 0.55

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
SCHEMBL9364363 1.00 TDP1 (0.67) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9365131 0.99 TDP1 (0.66) TDP1MAPTABCC4CNR1CTDSP1
Trifluoroacetic Acid SCHEMBL9364452 0.96 TDP1 (0.62) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9365147 0.92 TDP1 (0.59) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9226175 0.92 TDP1 (0.66) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL9228080 0.90 TDP1 (0.65) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL11034346 0.90 TDP1 (0.70) TDP1MAPTABCC4CNR1CTDSP1
SCHEMBL11034342 0.90 TDP1 (0.70) TDP1MAPTABCC4CNR1CTDSP1
Formic Acid SCHEMBL9225920 0.89 TDP1 (0.66) TDP1MAPTABCC4CNR1CTDSP1
Formic Acid SCHEMBL9225931 0.89 TDP1 (0.66) TDP1MAPTABCC4CNR1CTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0329457-B1 Cephalosporin derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-12-14 — — EP claimed
US-4921953-A ORAL ADMINISTRATION TAISHO PHARMACEUTICAL CO., LTD. (JP) 1990-05-01 — — US claimed
EP-0329457-B1 Cephalosporin derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-12-14 — — EP disclosed
US-4921953-A ORAL ADMINISTRATION TAISHO PHARMACEUTICAL CO., LTD. (JP) 1990-05-01 — — US disclosed
EP-0329457-A2 Cephalosporin derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1989-08-23 — — EP disclosed
Send feedback