SCHEMBL10140160

SCHEMBL10140160

Cc1cccnc1-n1nc(C(F)(F)F)cc1C(=O)Nc1c(C)cc(Cl)cc1C(=O)NC(C)C

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 4/20 0.37
KLKB1 P03952 3/20 0.36
TP53 P04637 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE4B Q07343 1/20 0.35
FAAH O00519 1/20 0.35
F10 P00742 1/20 0.35
CRACR2A Q9BSW2 3/20 0.35

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
SCHEMBL10140218 0.94 CARM1 (0.36) CARM1KLKB1TP53KDM4EMEN1
SCHEMBL672741 0.94 PDE4B (0.36) CARM1KLKB1KDM4EMEN1ALDH1A1
SCHEMBL10140166 0.91 CARM1 (0.38) CARM1KLKB1TP53KDM4EMEN1
SCHEMBL10140135 0.90 CARM1 (0.37) CARM1KLKB1TP53KDM4EMEN1
SCHEMBL10140185 0.89 RECQL (0.36) ALDH1A1MAPTKMT2AF10
SCHEMBL10140191 0.89 EPHX2 (0.33) MEN1ALDH1A1MAPTKMT2A
SCHEMBL12884466 0.88 F10 (0.35) CARM1KLKB1F10
SCHEMBL15693449 0.88 PDE4B (0.35) CARM1KLKB1KDM4EMEN1ALDH1A1
SCHEMBL10140202 0.88 KLKB1 (0.38) CARM1KLKB1TP53KDM4EMEN1
SCHEMBL14360665 0.87 KDM4E (0.37) CARM1KLKB1KDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9949482-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2018-04-24 US disclosed
US-20170071205-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2017-03-16 US disclosed
US-9538755-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2017-01-10 US disclosed
US-20160302414-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2016-10-20 US disclosed
US-9282743-B2 Chemical compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-03-15 US disclosed
US-9096525-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION, LLC (US) 2015-08-04 US disclosed
US-20140051736-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2014-02-20 US disclosed
US-8536089-B2 For controlling phytopathogenic diseases; synergistic SYNGENTA CROP PROTECTION LLC (US) 2013-09-17 US disclosed
US-20130210625-A1 SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES SYNGENTA CROP PROTECTION LLC (US) 2013-08-15 US disclosed
US-8124567-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, INC. (US) 2012-02-28 US disclosed
US-8124566-B2 Synergistic fungicidal compositions SYNGENTA CROP PROTECTION, INC. (US) 2012-02-28 US disclosed
US-20080076664-A1 Fungicidal Compositions SYNGENTA CROP PROTECTION, INC. 2008-03-27 US disclosed
US-20080070785-A1 For controlling phytopathogenic diseases; synergistic SYNGENTA CROP PROTECTION, INC. (US) 2008-03-20 US disclosed
US-20070265267-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, INC. (US) 2007-11-15 US disclosed
US-20070244121-A1 Synergistic Fungicidal Compositions SYNGENTA CROP PROTECTION, INC. (US) 2007-10-18 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 (8 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-20140051736-A1 FUNGICIDAL COMPOSITIONS PIK3C3, CYP51A1, CYP1B1 CARM1 2370/4885KLKB1 3263/4885TP53 3640/4885
US-20130210625-A1 SPIROHETEROCYCLIC PYRROLIDINE DERIVATIVES BASED PESTICIDES DDT, PYCR1, PKD2 CARM1 1438/4885KLKB1 4616/4885TP53 2499/4885
US-20160302414-A1 INSECTICIDAL COMPOUNDS ACHE, AADAC, CASP3 CARM1 3399/4885KLKB1 3945/4885TP53 4868/4885
US-20070265267-A1 FUNGICIDAL COMPOSITIONS CRY1, ERG28, DDT CARM1 832/4885KLKB1 4648/4885TP53 4665/4885
US-20070244121-A1 Synergistic Fungicidal Compositions DDT, CRY1, HCN1 CARM1 1036/4885KLKB1 4832/4885TP53 4725/4885
US-20080070785-A1 For controlling phytopathogenic diseases; synergistic BROX, EPM2A, MANBA CARM1 3494/4885KLKB1 3750/4885TP53 3380/4885
US-20170071205-A1 FUNGICIDAL COMPOSITIONS PIK3C3, CYP51A1, CYP1B1 CARM1 2370/4885KLKB1 3263/4885TP53 3640/4885
US-20080076664-A1 Fungicidal Compositions AKR7A2, CYP51A1, TUBA3C CARM1 2578/4885KLKB1 4124/4885TP53 4397/4885

“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.