SCHEMBL9367883

SCHEMBL9367883

C#Cc1ccc(Br)c(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.39
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 2/20 0.37
XBP1 P17861 1/20 0.37
HTT P42858 2/20 0.36
EPHX1 P07099 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TMPRSS4 Q9NRS4 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTPN1 P18031 2/20 0.34
TRPV4 Q9HBA0 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
ALKBH5 Q6P6C2 1/20 0.34
IDO1 P14902 1/20 0.33

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
SCHEMBL31038840 0.83 KIF11 (0.40) NOTUMTMPRSS4PTPN1TRPV4
SCHEMBL21776816 0.83 KIF11 (0.40) NOTUMTMPRSS4PTPN1TRPV4
SCHEMBL16955243 0.80 NOTUM (0.39) NOTUMMAPTMEN1KMT2ANPSR1
SCHEMBL403023 0.80 TRPV4 (0.53) NOTUMMAPTMEN1KMT2ANPSR1
SCHEMBL5546385 0.80 MAPT (0.41) NOTUMMAPTMEN1KMT2ANPSR1
SCHEMBL31026088 0.80 TRPV4 (0.53) NOTUMMAPTMEN1KMT2ANPSR1
SCHEMBL4927725 0.78 KIF11 (0.41) NOTUMPTPN1TRPV4
SCHEMBL30967278 0.78 KIF11 (0.41) NOTUMPTPN1TRPV4
SCHEMBL9793597 0.78 AR (0.39) PTPN1TRPV4
SCHEMBL20929103 0.76 FFAR4 (0.37) SMN1; SMN2PTPN1TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1096449-C Process for preparing substituted arylpyrazoles BAYER AG (DE) 2002-12-18 CN claimed
EP-0480795-B1 Benzofuran derivatives, procedure of their preparation, novel intermediates obtained, and their application as pesticides ROUSSEL UCLAF (FR) 1994-09-07 EP disclosed
US-5182295-A Miticides, fungicides ROUSSEL UCLAF (FR) 1993-01-26 US disclosed
EP-0480795-A1 Benzofuran derivatives, procedure of their preparation, novel intermediates obtained, and their application as pesticides ROUSSEL-UCLAF (FR) 1992-04-15 EP disclosed