SCHEMBL17047743

SCHEMBL17047743

CC1=C(C)C(=O)N(c2ccc(C(F)(F)F)cc2)C1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.45
GSK3A P49840 1/20 0.45
GSK3B P49841 1/20 0.45
XPO1 O14980 1/20 0.43
TRPV1 Q8NER1 1/20 0.40
ITGA4 P13612 1/20 0.40
ITGB7 P26010 1/20 0.40
CYP11B2 P19099 1/20 0.40
MPI P34949 1/20 0.39
PHOSPHO1 Q8TCT1 1/20 0.39
F2 P00734 1/20 0.39
ELANE P08246 1/20 0.39
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
CTRC Q99895 1/20 0.39
PARP1 P09874 1/20 0.39
PARP15 Q460N3 1/20 0.39
PARP10 Q53GL7 1/20 0.39
DPP8 Q6V1X1 1/20 0.38
CFTR P13569 1/20 0.38

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
SCHEMBL23352458 0.80 RAD51 (0.40) RAD51GSK3AGSK3BTRPV1ITGA4
SCHEMBL23352456 0.80 GSK3A (0.43) RAD51GSK3AGSK3BTRPV1ITGA4
SCHEMBL17047810 0.80 XPO1 (0.56) RAD51XPO1PARP1PARP15PARP10
SCHEMBL12556880 0.79 ALDH1A1 (0.55) F2ELANECTSGCMA1CTRC
SCHEMBL22129224 0.78 KMT2A (0.58)
SCHEMBL5533700 0.78 POLB (0.58) RAD51GSK3AGSK3B
SCHEMBL17047686 0.78 AR (0.57) MPIPHOSPHO1PARP1PARP15PARP10
SCHEMBL15849078 0.76 ELANE (0.65) F2ELANECTSGCMA1CTRC
SCHEMBL9612030 0.76 CFTR (0.44) RAD51GSK3AGSK3BTRPV1ITGA4
SCHEMBL29644728 0.76 KIF11 (0.53) RAD51TRPV1ITGA4ITGB7MPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106029652-B Plant growth regulating compound 先正达参股股份有限公司 2019-08-13 CN disclosed
EP-3110808-B1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-08-29 EP disclosed
US-9751867-B2 Plant growth regulating compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-09-05 US disclosed
EP-3110808-A1 PLANT GROWTH REGULATING COMPOUNDS Syngenta Participations AG (CH) 2017-01-04 EP disclosed
US-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-12-22 US disclosed
CN-106029652-A Plant growth regulating compounds 先正达参股股份有限公司 2016-10-12 CN disclosed
WO-2015128321-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-03 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 (1 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-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS GHDC, GAK, EIF4G2 RAD51 4713/4885GSK3A 908/4885GSK3B 675/4885

“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.