SCHEMBL7229102

SCHEMBL7229102

Cc1[c]nc(-c2ccc(F)cc2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 0.42
TRPM8 Q7Z2W7 2/20 0.37
ALOX5 P09917 1/20 0.37
KDM4E B2RXH2 2/20 0.36
TSHR P16473 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SULT1A1 P50225 1/20 0.36
AR P10275 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DCK P27707 1/20 0.35
ACHE P22303 1/20 0.34
GAA P10253 1/20 0.34
PDE1A P54750 1/20 0.34
PDE1B Q01064 1/20 0.34
PDE7A Q13946 1/20 0.34

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
SCHEMBL7174034 0.81 CASP3 (0.46) TRPM8ALOX5KDM4ETSHRUSP2
SCHEMBL27921601 0.80 ALOX5 (0.39) APPALOX5KDM4ESULT1A1AR
SCHEMBL1435544 0.80 SMN1; SMN2 (0.41) ALOX5ALDH1A1NPSR1SMN1; SMN2GAA
SCHEMBL1458794 0.78 KDM4E (0.43) KDM4ETSHRALDH1A1HSD17B10KMT2A
SCHEMBL1435944 0.74 PIK3CA (0.39) TSHRHSD17B10
SCHEMBL21346519 0.68 SMN1; SMN2 (0.60) APPALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL14970084 0.68 NPC1 (0.50) APPKDM4ETSHRUSP2ALDH1A1
SCHEMBL2090445 0.67 APP (0.44) APPTRPM8ALOX5KDM4ETSHR
SCHEMBL2095368 0.67 APP (0.51) APPTRPM8ALOX5SULT1A1DCK
SCHEMBL5395670 0.67 APP (0.44) APPTRPM8KDM4ETSHRUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605631-B1 Controlling fungi and pests; improved activity and plant tolerability BASF AKTIENGESELLSCHAFT (DE) 2003-08-12 US disclosed
US-6031110-A Ortho-substituted 2-methoxyiminophenyl-N-methylacetamides BASF AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed