SCHEMBL12337052

SCHEMBL12337052

CSC(=N)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
HTT P42858 1/20 0.58
RAB9A P51151 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.56
GAA P10253 3/20 0.55
ALDH1A1 P00352 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
TP53 P04637 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
IDO1 P14902 1/20 0.53
LMNA P02545 2/20 0.52

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
Iodide SCHEMBL10827355 0.98 MAPT (0.56) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL7979826 0.83 LMNA (0.53) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL2288364 0.81 MAPT (0.64) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL4851241 0.81 SMN1; SMN2 (0.66) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL12336328 0.80 MAPT (0.54) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL23720127 0.79 L3MBTL1 (0.58) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL12336440 0.78 MAPT (0.55) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL3826992 0.78 MAPT (0.60) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL1999954 0.78 ALDH1A1 (0.61) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL13385658 0.77 L3MBTL1 (0.56) MAPTMEN1KMT2AHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550266-B1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTICS SOLUTIONS INC (US) 2018-05-09 EP disclosed
US-20160237064-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ALLOSTERIC KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-08-18 US disclosed
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 US disclosed
US-9260417-B2 Therapeutic methods and compositions involving allosteric kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2016-02-16 US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 US disclosed
US-20140296268-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ALLOSTERIC KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS, INC. 2014-10-02 US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 US disclosed
WO-2011119894-A2 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION KINAGEN, INC (US) 2011-09-29 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 (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-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION MAP4K2, MAP3K20, MAP3K19 MAPT 4114/4885MEN1 2954/4885KMT2A 900/4885
US-20160237064-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ALLOSTERIC KINASE INHIBITION TIE1, PRKCH, PACSIN2 MAPT 3053/4885MEN1 3632/4885KMT2A 1922/4885
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 MAPT 4114/4885MEN1 2954/4885KMT2A 900/4885
US-20140296268-A1 THERAPEUTIC METHODS AND COMPOSITIONS INVOLVING ALLOSTERIC KINASE INHIBITION TIE1, PRKCH, PACSIN2 MAPT 3053/4885MEN1 3632/4885KMT2A 1922/4885
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 MAPT 4114/4885MEN1 2954/4885KMT2A 900/4885

“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.