SCHEMBL8769348

SCHEMBL8769348

Cc1ccn2nc(S(=O)(=O)Nc3ccccc3F)nc2n1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
PSIP1 O75475 1/20 0.40
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTR6 P50406 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.37

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
Flumetsulam SCHEMBL54906 0.88 TSHR (0.40) GAASMN1; SMN2HTR6TSHR
Flumetsulam SCHEMBL20723426 0.86 TSHR (0.39) GAASMN1; SMN2HTR6TSHR
Flumetsulam SCHEMBL20723449 0.86 TSHR (0.39) GAASMN1; SMN2HTR6TSHR
SCHEMBL11056313 0.86 TSHR (0.35) HTR6TSHR
SCHEMBL9831797 0.85 KMT2A (0.47) GAAPOLBSMN1; SMN2SLC22A12TSHR
SCHEMBL9832538 0.84 TSHR (0.38) SMN1; SMN2HTR6TSHR
Flumetsulam SCHEMBL22587375 0.82 TSHR (0.37) GAASMN1; SMN2HTR6TSHR
SCHEMBL9832548 0.82 HTR6 (0.39) HTR6TSHRKDM4E
SCHEMBL8762523 0.82 TSHR (0.46) PKMGAAHTR6TSHRKDM4E
SCHEMBL9832187 0.81 TSHR (0.36) HTR6SLC22A12TSHR

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
EP-0784431-A1 SYNERGISTIC ACTIVE SUBSTANCE HERBICIDE COMBINATIONS WITH 1-(2,6-DICHLORO-4-DIFLUOROMETHYL-PHENYL)-5-(2-CHLOROPROPIONAMIDO)-4-NITROPYRAZOL BAYER AG (DE) 1997-07-23 EP claimed
WO-1996010333-A1 SYNERGISTIC ACTIVE SUBSTANCE HERBICIDE COMBINATIONS WITH 1-(2,6-DICHLORO-4-DIFLUOROMETHYL-PHENYL)-5-(2-CHLOROPROPIONAMIDO)-4-NITROPYRAZOL BAYER AKTIENGESELLSCHAFT (DE) 1996-04-11 WO claimed