SCHEMBL9533340

SCHEMBL9533340

FC(F)Sc1nnc(-c2ccccn2)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.61
RAB9A P51151 8/20 0.61
NPC1 O15118 7/20 0.61
MAPT P10636 2/20 0.61
ATM Q13315 1/20 0.61
SMN1; SMN2 Q16637 7/20 0.43
ALDH1A1 P00352 3/20 0.43
GLA P06280 1/20 0.42
HSD17B10 Q99714 7/20 0.41
TP53 P04637 4/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL10565441 0.78 TERT (0.54) KDM4ERAB9ANPC1ALDH1A1HSD17B10
SCHEMBL1424929 0.77 KDM4E (1.00) KDM4ERAB9ANPC1MAPTATM
SCHEMBL9820493 0.74 KDM4E (0.53) KDM4ERAB9ANPC1MAPTSMN1; SMN2
SCHEMBL9532116 0.72 KMT2A (0.50) KDM4ERAB9ANPC1MAPTATM
SCHEMBL29870798 0.71 KDM4E (0.77) KDM4ERAB9ANPC1MAPTATM
SCHEMBL15671504 0.71 KDM4E (0.77) KDM4ERAB9ANPC1MAPTATM
SCHEMBL17135790 0.69 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL11982530 0.69 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL971007 0.69 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL8143194 0.69 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM

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
EP-0285565-B1 2-MERCAPTO-5-PYRIDYL-1,3,4-OXADIAZOLES AND 1,3,4-THIADIAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS NEMATICIDAL AGENTS CIBA-GEIGY AG (CH) 1993-09-15 EP claimed
US-4894380-A NEMATOCIDES CIBA-GEIGY CORPORATION (US) 1990-01-16 US claimed
EP-0285565-A2 2-Mercapto-5-pyridyl-1,3,4-oxadiazoles and 1,3,4-thiadiazoles, process for their preparation and their use as nematicidal agents CIBA-GEIGY AG (CH) 1988-10-05 EP claimed
EP-0285565-B1 2-MERCAPTO-5-PYRIDYL-1,3,4-OXADIAZOLES AND 1,3,4-THIADIAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS NEMATICIDAL AGENTS CIBA-GEIGY AG (CH) 1993-09-15 EP disclosed
US-4894380-A NEMATOCIDES CIBA-GEIGY CORPORATION (US) 1990-01-16 US disclosed
EP-0285565-A2 2-Mercapto-5-pyridyl-1,3,4-oxadiazoles and 1,3,4-thiadiazoles, process for their preparation and their use as nematicidal agents CIBA-GEIGY AG (CH) 1988-10-05 EP disclosed