SCHEMBL9624192

SCHEMBL9624192

C(=C\c1ccccn1)\SC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ ATM Q13315 1/20 0.54
▸ GRM4 Q14833 1/20 0.43
▸ MAOA P21397 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ NR4A1 P22736 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ NFE2L2 Q16236 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ G6PC1 P35575 1/20 0.36

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
SCHEMBL9624194 1.00 NPC1 (0.54) NPC1RAB9AKMT2AMEN1ATM
SCHEMBL3332557 0.78 GRM5 (0.33) —
SCHEMBL3332564 0.78 GRM5 (0.33) —
SCHEMBL9624613 0.73 CYP11B2 (0.58) NPC1RAB9AKMT2AMEN1GRM4
SCHEMBL9624615 0.73 CYP11B2 (0.58) NPC1RAB9AKMT2AMEN1GRM4
SCHEMBL19538990 0.72 NPC1 (0.62) NPC1RAB9AKMT2AMEN1ATM
SCHEMBL229328 0.72 NPC1 (1.00) NPC1RAB9AKMT2AMEN1ATM
SCHEMBL229329 0.72 NPC1 (1.00) NPC1RAB9AKMT2AMEN1ATM
SCHEMBL9394256 0.72 NPC1 (1.00) NPC1RAB9AKMT2AMEN1ATM
SCHEMBL31560044 0.72 NPC1 (1.00) NPC1RAB9AKMT2AMEN1ATM

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
EP-0145906-B1 CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-11 — — EP disclosed
US-4985555-A MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-01-15 — — US disclosed
US-4871730-A MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-10-03 — — US disclosed
EP-0268307-A2 New starting compounds for cephem compounds and processes for their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-05-25 — — EP disclosed
US-4622318-A MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-11-11 — — US disclosed
EP-0145906-A2 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-06-26 — — EP disclosed
EP-0133678-A2 New cephem compounds, processes for preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-03-06 — — EP disclosed
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