SCHEMBL15965601

SCHEMBL15965601

Cc1cc(C2=NO[C@](c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(=O)NCC1CSC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.35
CYP3A4 P08684 3/20 0.34
CYP2C9 P11712 3/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C19 P33261 2/20 0.34
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAPK14 Q16539 3/20 0.32
MAPK11 Q15759 1/20 0.32
CHRM1 P11229 3/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM3 P20309 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CYP1A2 P05177 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
SCHEMBL14721762 1.00 CNR2 (0.35) CNR2CYP3A4CYP2C9CYP2D6CYP2C19
SCHEMBL14721759 1.00 CNR2 (0.35) CNR2CYP3A4CYP2C9CYP2D6CYP2C19
Formic Acid SCHEMBL15878533 0.97 CNR2 (0.34) CNR2CYP3A4CYP2C9CYP2D6CYP2C19
SCHEMBL14734016 0.90 CNR2 (0.35) CNR2CYP3A4CYP2C9CYP2D6CYP2C19
SCHEMBL15881951 0.90 CNR2 (0.35) CNR2CYP3A4CYP2C9CYP2D6CYP2C19
SCHEMBL14727931 0.90 CNR2 (0.35) CNR2CYP3A4CYP2C9CYP2D6CYP2C19
SCHEMBL12497911 0.87 TTK (0.34) NPC1RAB9ACA1CA2
SCHEMBL2369205 0.87 TTK (0.34) NPC1RAB9ACA1CA2
SCHEMBL8515408 0.87 TTK (0.34) NPC1RAB9ACA1CA2
SCHEMBL740369 0.87 CA1 (0.34) CYP3A4ALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10710991-B2 Process for the preparation of thietane derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-07-14 US disclosed
US-20190315728-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-10-17 US disclosed
US-10266524-B2 Process for the preparation of thietane derivatives SYNGENTA PARTICIPATIONS AG (CH) 2019-04-23 US disclosed
US-20170247361-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-08-31 US disclosed
US-20170247361-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-08-31 US disclosed
US-9682949-B2 Process for the preparation of thietane derivatives SYNGENTA PARTICIPATIONS AG (CH) 2017-06-20 US disclosed
US-9682949-B2 Process for the preparation of thietane derivatives SYNGENTA PARTICIPATIONS AG (CH) 2017-06-20 US disclosed
US-9204648-B2 Process for the preparation of thietane derivatives SYNGENTA PARTICIPATIONS AG (CH) 2015-12-08 US disclosed
US-9204648-B2 Process for the preparation of thietane derivatives SYNGENTA PARTICIPATIONS AG (CH) 2015-12-08 US disclosed
US-20140235869-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2014-08-21 US disclosed
US-20140235869-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2014-08-21 US 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 (5 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-20170247361-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES CYP4B1, CYP1B1, CYP1A1 CNR2 1381/4885CYP3A4 4/4885CYP2C9 13/4885
US-20140235869-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES CYP4B1, CYP1B1, CYP1A1 CNR2 1504/4885CYP3A4 4/4885CYP2C9 13/4885
US-10710991-B2 Process for the preparation of thietane derivatives CYP4B1, CYP1B1, CYP1A1 CNR2 1381/4885CYP3A4 4/4885CYP2C9 13/4885
US-20190315728-A1 PROCESS FOR THE PREPARATION OF THIETANE DERIVATIVES CYP4B1, CYP1B1, CYP1A1 CNR2 1381/4885CYP3A4 4/4885CYP2C9 13/4885
US-10266524-B2 Process for the preparation of thietane derivatives CYP4B1, CYP1B1, CYP1A1 CNR2 1381/4885CYP3A4 4/4885CYP2C9 13/4885

“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.