SCHEMBL325802

SCHEMBL325802

Cc1cc(C2=NCC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(=O)NC1CSC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TTK P33981 12/20 0.34
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
USP30 Q70CQ3 1/20 0.32
HPGD P15428 1/20 0.32
CRHR1 P34998 1/20 0.31

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
SCHEMBL14726009 0.96 TTK (0.34) TTKNPC1RAB9AUSP30HPGD
SCHEMBL1806620 0.92 TTK (0.34) TTKNPC1RAB9AUSP30HPGD
SCHEMBL19063431 0.92 TTK (0.34) TTKNPC1RAB9AUSP30HPGD
SCHEMBL14855742 0.90 SMN1; SMN2 (0.35) TTKUSP30CRHR1
SCHEMBL3665360 0.90 SMN1; SMN2 (0.35) TTKUSP30CRHR1
SCHEMBL15239866 0.90 SMN1; SMN2 (0.35) TTKUSP30CRHR1
SCHEMBL1806024 0.89 RXRA (0.38) TTKUSP30CRHR1
SCHEMBL12173977 0.89 TTK (0.33) TTKUSP30CRHR1
SCHEMBL20336183 0.89
SCHEMBL20336147 0.88 CNR2 (0.34) NPC1RAB9A

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10364235-B2 Insecticidal compounds Synenta Crop Protection LLC (US) 2019-07-30 US disclosed
US-10364235-B2 Insecticidal compounds Synenta Crop Protection LLC (US) 2019-07-30 US disclosed
US-20180065956-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2018-03-08 US disclosed
US-20180065956-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2018-03-08 US disclosed
US-9834546-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2017-12-05 US disclosed
US-9834546-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2017-12-05 US disclosed
US-20170022187-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2017-01-26 US disclosed
US-20170022187-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2017-01-26 US disclosed
US-9493445-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2016-11-15 US disclosed
US-9493445-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2016-11-15 US disclosed
US-20130131137-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-05-23 US disclosed
EP-2445906-A1 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2012-05-02 EP disclosed
WO-2012049327-A2 PESTICIDAL MIXTURES SYNGENTA PARTICIPATIONS AG (CH) 2012-04-19 WO disclosed
US-8158560-B2 Insecticidal arylpyrroline compounds BAYER CROPSCIENCE AG (DE) 2012-04-17 US disclosed
WO-2012004326-A1 PESTICIDAL PYRROLINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2012-01-12 WO disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
US-20110118319-A1 Insecticidal Arylpyrroline Compounds BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
WO-2010149506-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-12-29 WO disclosed
WO-2010149506-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-12-29 WO disclosed
WO-2010020522-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-02-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170022187-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 TTK 4789/4885NPC1 319/4885RAB9A 193/4885
US-20130131137-A1 INSECTICIDAL COMPOUNDS F5, CHRM1, CHRM2 TTK 3823/4885NPC1 995/4885RAB9A 116/4885
US-10364235-B2 Insecticidal compounds ACHE, CHRM1, NIT2 TTK 4789/4885NPC1 319/4885RAB9A 193/4885
US-20110118319-A1 Insecticidal Arylpyrroline Compounds DDT, LAP3, CYP4X1 TTK 4822/4885NPC1 4027/4885RAB9A 797/4885
US-20180065956-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 TTK 4789/4885NPC1 319/4885RAB9A 193/4885
US-20110269804-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, C1R TTK 4641/4885NPC1 562/4885RAB9A 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.