SCHEMBL3668823

SCHEMBL3668823

Cc1cc(C2=NOC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)(C(F)(F)F)C2)ccc1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.40
RXRB P28702 3/20 0.40
PDE3B Q13370 4/20 0.33
PDE3A Q14432 4/20 0.33
NR1H2 P55055 3/20 0.33
NR1H3 Q13133 3/20 0.33
MIF P14174 1/20 0.32
TACR1 P25103 1/20 0.32
RXRG P48443 1/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.30
HDAC4 P56524 1/20 0.30

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
SCHEMBL2011937 0.94 RXRA (0.35) RXRARXRBNR1H2NR1H3MIF
SCHEMBL3730602 0.92 RXRA (0.35) RXRARXRBNR1H2NR1H3MIF
SCHEMBL31622456 0.90 RXRA (0.41) RXRARXRBPDE3BPDE3ARXRG
SCHEMBL14722603 0.90 MIF (0.32) RXRARXRBPDE3BPDE3AMIF
SCHEMBL14722605 0.90 MIF (0.32) RXRARXRBPDE3BPDE3AMIF
SCHEMBL14721680 0.89 MIF (0.33) RXRARXRBPDE3BPDE3AMIF
SCHEMBL14721679 0.89 MIF (0.33) RXRARXRBPDE3BPDE3AMIF
SCHEMBL1358620 0.89 KDM4E (0.33) MIFTP53MAPTALOX15HSD17B10
SCHEMBL12522431 0.88 MIF (0.31) PDE3BPDE3AMIFTP53MAPT
SCHEMBL30855392 0.87 RXRB (0.55) RXRARXRBPDE3BPDE3ARXRG

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
US-20140080877-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, LLC (US) 2014-03-20 US disclosed
US-8623896-B2 Insecticidal compounds SYNGENTA CROP PROTECTION, LLC (US) 2014-01-07 US disclosed
EP-2592079-A2 Insecticidal compounds Syngenta Participations AG. (CH) 2013-05-15 EP disclosed
EP-2518068-A2 Insecticidal compounds Syngenta Participations AG. (CH) 2012-10-31 EP disclosed
EP-2238132-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2012-08-01 EP disclosed
US-20100279999-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 US disclosed
EP-2238132-A2 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2010-10-13 EP disclosed
WO-2009080250-A2 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-07-02 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 (2 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-20100279999-A1 INSECTICIDAL COMPOUNDS CHRM1, ACHE, CHRM2 RXRA 3246/4885RXRB 3764/4885PDE3B 92/4885
US-20140080877-A1 INSECTICIDAL COMPOUNDS CHRM1, ACHE, CHRM2 RXRA 3283/4885RXRB 3766/4885PDE3B 86/4885

“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.