SCHEMBL7830009

SCHEMBL7830009

CS(=O)(=O)c1nnc(-c2cccc(C(F)(F)F)c2)o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 3/20 0.61
▸ RAB9A P51151 4/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ HTT P42858 1/20 0.54
▸ KDM4E B2RXH2 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ ADCY1 Q08828 2/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ ATR Q13535 1/20 0.43
▸ USP2 O75604 1/20 0.42
▸ UTRN P46939 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ MAOB P27338 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL27874334 0.81 NOTUM (0.54) NOTUMRAB9ANPC1KDM4ESMN1; SMN2
SCHEMBL3491241 0.81 AURKA (0.48) NOTUMKDM4EMAPTTHRBGAA
SCHEMBL27857785 0.78 RAB9A (0.59) NOTUMRAB9ANPC1KDM4ESMN1; SMN2
SCHEMBL27418746 0.78 RAB9A (0.64) NOTUMRAB9ANPC1HTTKDM4E
SCHEMBL12360483 0.77 NPC1 (0.63) NOTUMRAB9ANPC1HTTKDM4E
SCHEMBL14452782 0.77 KDM4E (0.66) NOTUMRAB9ANPC1HTTKDM4E
SCHEMBL408280 0.77 RAB9A (0.57) NOTUMRAB9ANPC1KDM4ESMN1; SMN2
SCHEMBL9269014 0.76 MAPT (0.46) NOTUMRAB9AMAPTSMN1; SMN2THRB
SCHEMBL21776908 0.76 NOTUM (1.00) NOTUMKDM4EPTGS2MAOBCYP1A2
SCHEMBL8567669 0.75 MAPT (0.48) NOTUMRAB9ANPC1HTTKDM4E

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-0670836-B1 PYRIDYL-1,2,4-THIADIAZOLES AS PEST-CONTROL AGENTS BAYER AG (DE) 2001-10-04 — — EP disclosed
US-6100402-A Pyridyl-1,2,4-thiadiazoles BAYER AKTIENGESELLSCHAFT (DE) 2000-08-08 — — US disclosed
US-6031104-A Pyridyl-1,2,4-thiadiazoles BAYER AKTIENGESELLSCHAFT (DE) 2000-02-29 — — US disclosed
US-5756523-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-05-26 — — US disclosed
US-5633267-A FUNGICIDES FOR PLANTS BAYER AKTIENGESELLSCHAFT (DE) 1997-05-27 — — US disclosed
EP-0670836-A1 PYRIDYL-1,2,4-THIADIAZOLES AS PEST-CONTROL AGENTS BAYER AG (DE) 1995-09-13 — — EP disclosed
WO-1994012496-A1 PYRIDYL-1,2,4-THIADIAZOLES AS PEST-CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1994-06-09 — — WO disclosed
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