SCHEMBL11942292

SCHEMBL11942292

Cc1cc(C#N)nc(C)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HTT P42858 2/20 0.38
GLA P06280 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.36
EGLN2 Q96KS0 2/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MBOAT4 Q96T53 1/20 0.33
CYP3A4 P08684 1/20 0.33
CHRM1 P11229 1/20 0.33
ALOX15 P16050 1/20 0.33
MAOA P21397 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL31161591 0.80 MEN1 (0.36) MEN1KMT2AHTTGLATSHR
SCHEMBL11986180 0.78 KDM4E (0.35) MEN1KMT2AHTTTSHRKDM4E
SCHEMBL11986177 0.75 ALDH1A1 (0.40) MEN1KMT2AHTTGLATSHR
SCHEMBL14853157 0.75 KDM4E (0.33) MEN1KMT2AKDM4EEGLN2MBOAT4
SCHEMBL11986175 0.75 ALDH1A1 (0.38) MEN1KMT2AHTTGLATSHR
SCHEMBL11942295 0.75 CYP1A2 (0.35) MEN1KMT2AKDM4EEGLN2CYP1A2
SCHEMBL14853156 0.75 KDM4E (0.41) MEN1KMT2AHTTTSHRKDM4E
SCHEMBL18398259 0.72 ALDH1A1 (0.39) MEN1KMT2AHTTTSHRKDM4E
SCHEMBL13462533 0.72 KDM5A (0.39) MEN1KMT2AKDM4ERECQL
SCHEMBL13600035 0.72 RECQL (0.40) TSHRKDM4EALDH1A1CYP1A2CYP2C9

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
US-8993772-B2 Process for the preparation of 4-amino-5-fluoro-3-halo-6-(substituted)picolinates DOW AGROSCIENCES, LLC. (US) 2015-03-31 US disclosed
US-8993772-B2 Process for the preparation of 4-amino-5-fluoro-3-halo-6-(substituted)picolinates DOW AGROSCIENCES, LLC. (US) 2015-03-31 US disclosed
US-20140206881-A1 PROCESS FOR THE PREPARATION OF 4-AMINO-5-FLUORO-3-HALO-6-(SUBSTITUTED)PICOLINATES DOW AGROSCIENCES LLC (US) 2014-07-24 US disclosed
US-20140206881-A1 PROCESS FOR THE PREPARATION OF 4-AMINO-5-FLUORO-3-HALO-6-(SUBSTITUTED)PICOLINATES DOW AGROSCIENCES LLC (US) 2014-07-24 US disclosed
US-8754231-B2 Process for the preparation of 4-amino-5-fluoro-3-halo-6-(substituted)picolinates DOW AGROSCIENCES, LLC. (US) 2014-06-17 US disclosed
US-8754231-B2 Process for the preparation of 4-amino-5-fluoro-3-halo-6-(substituted)picolinates DOW AGROSCIENCES, LLC. (US) 2014-06-17 US disclosed
US-20120190859-A1 PROCESS FOR THE PREPARATION OF 4-AMINO-5-FLUORO-3-HALO-6-(SUBSTITUTED)PICOLINATES DOW AGROSCIENCES LLC (US) 2012-07-26 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 (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-20120190859-A1 PROCESS FOR THE PREPARATION OF 4-AMINO-5-FLUORO-3-HALO-6-(SUBSTITUTED)PICOLINATES CYP4F3, CYP4F12, AFF4 MEN1 2560/4885KMT2A 2156/4885HTT 1394/4885
US-20140206881-A1 PROCESS FOR THE PREPARATION OF 4-AMINO-5-FLUORO-3-HALO-6-(SUBSTITUTED)PICOLINATES CYP4F3, CYP4F12, AFF4 MEN1 2560/4885KMT2A 2156/4885HTT 1394/4885

“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.