SCHEMBL9481965

SCHEMBL9481965

C=CC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(NC(=O)/C(=N/OCC(=O)OC(c3ccccc3)c3ccccc3)c3csc(N)n3)[C@H]2SC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.71
▸ APAF1 O14727 2/20 0.71
▸ APEX1 P27695 2/20 0.71
▸ LMNA P02545 1/20 0.71
▸ TSHR P16473 1/20 0.71
▸ PLCG1 P19174 1/20 0.71
▸ ABCC2 Q92887 1/20 0.71
▸ SIRT5 Q9NXA8 1/20 0.71
▸ L3MBTL1 Q9Y468 1/20 0.71
▸ PSMD14 O00487 1/20 0.70
▸ MMP2 P08253 1/20 0.70
▸ MAPT P10636 4/20 0.61
▸ ABCC4 O15439 1/20 0.61
▸ CNR1 P21554 1/20 0.61
▸ CTDSP1 Q9GZU7 1/20 0.61
▸ NR1I2 O75469 5/20 0.52
▸ HTR2C P28335 1/20 0.52
▸ PTGS1 P23219 2/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ PDE4D Q08499 1/20 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
SCHEMBL9481972 1.00 TDP1 (0.71) TDP1APAF1APEX1LMNATSHR
SCHEMBL9481309 0.96 TDP1 (0.69) TDP1APAF1APEX1LMNATSHR
SCHEMBL9481314 0.96 TDP1 (0.69) TDP1APAF1APEX1LMNATSHR
SCHEMBL9742980 0.94 TDP1 (0.66) TDP1APAF1APEX1LMNATSHR
SCHEMBL9481496 0.94 TDP1 (0.66) TDP1APAF1APEX1LMNATSHR
SCHEMBL9482891 0.94 TDP1 (0.66) TDP1APAF1APEX1LMNATSHR
SCHEMBL9481492 0.94 TDP1 (0.66) TDP1APAF1APEX1LMNATSHR
SCHEMBL9482894 0.94 TDP1 (0.66) TDP1APAF1APEX1LMNATSHR
SCHEMBL9482363 0.94 TDP1 (0.69) TDP1APAF1APEX1LMNATSHR
SCHEMBL9482372 0.94 TDP1 (0.69) TDP1APAF1APEX1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5252731-A Antibiotics FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-12 — — US disclosed
US-5110921-A Bactericides FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-05-05 — — US disclosed
US-4960889-A CEPHALOSPORIN INTERMEDIATES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-10-02 — — US disclosed
US-4731443-A 7-acylamino-3-vinylcephalosporanic acid derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-15 — — US disclosed
US-4487927-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-12-11 — — US disclosed
US-4423213-A ANTIBIOTIC FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-12-27 — — US disclosed
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