SCHEMBL7460965

SCHEMBL7460965

Clc1cc(Cl)c2c(Oc3ccccc3)ccnc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.46
CYP2C9 P11712 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
FGFR2 P21802 2/20 0.39
ALDH1A1 P00352 1/20 0.38
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
ACLY P53396 1/20 0.38
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
ERBB3 P21860 1/20 0.38
ERBB4 Q15303 1/20 0.38
DPP4 P27487 1/20 0.37
PARG Q86W56 1/20 0.37
STK39 Q9UEW8 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 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
SCHEMBL7532122 0.89 NR4A2 (0.40) CYP2C9SMN1; SMN2LMNATSHRAPEX1
Quinoxyfen SCHEMBL28247243 0.87 RET (0.42) CYP2C9CYP1A2CYP3A4CYP2C19EGFR
Quinoxyfen SCHEMBL22257 0.87 RET (0.42) CYP2C9CYP1A2CYP3A4CYP2C19EGFR
Quinoxyfen SCHEMBL1974400 0.85 RET (0.41) CYP2C9CYP1A2CYP3A4CYP2C19EGFR
Quinoxyfen SCHEMBL7471425 0.85 RET (0.41) CYP2C9CYP1A2CYP3A4CYP2C19EGFR
SCHEMBL7461330 0.84 RHEB (0.46) ALDH1A1EGFRERBB2ERBB3ERBB4
SCHEMBL7466633 0.84 EGFR (0.54) ALDH1A1NPSR1EGFRSMN1; SMN2LMNA
SCHEMBL7460172 0.83 MERTK (0.42) EGFRERBB2ERBB3ERBB4KMT2A
SCHEMBL7050110 0.81 EGFR (0.41) EGFRERBB2ERBB3ERBB4MEN1
Quinoxyfen SCHEMBL28210064 0.80 RET (0.40) EGFRERBB2KITPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP claimed
US-5240940-A Synergistic nmixture DOWELANCO (US) 1993-08-31 US claimed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US claimed
EP-0326330-A2 Quinoline, quinazoline, and cinnoline fungicides DowElanco (US) 1989-08-02 EP claimed
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP disclosed
US-5240940-A Synergistic nmixture DOWELANCO (US) 1993-08-31 US disclosed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US disclosed
EP-0326330-A2 Quinoline, quinazoline, and cinnoline fungicides DowElanco (US) 1989-08-02 EP disclosed