SCHEMBL10156084

SCHEMBL10156084

CSc1nc(Cl)cc(Nc2cnc(Cl)c(C(F)(F)F)c2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PTGES O14684 2/20 0.38
ALOX5 P09917 2/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
AURKA O14965 2/20 0.36
AURKB Q96GD4 2/20 0.36
PPARA Q07869 4/20 0.35
PIK3CD O00329 1/20 0.34
PPARG P37231 4/20 0.34
RXRA P19793 1/20 0.34
RXRG P48443 1/20 0.34
PPARD Q03181 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
GABRG2 P18507 1/20 0.32

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
SCHEMBL10127228 0.74 KIT (0.39) PPARGTRPV1POLB
SCHEMBL10156010 0.74 MEN1 (0.64) MEN1KMT2AGAASMN1; SMN2PTGES
SCHEMBL10157859 0.73 MEN1 (0.60) MEN1KMT2AGAASMN1; SMN2TP53
SCHEMBL2090416 0.71 MEN1 (0.73) MEN1KMT2AGAASMN1; SMN2PTGES
SCHEMBL10156743 0.70 MEN1 (0.63) MEN1KMT2AGAASMN1; SMN2ALOX5
SCHEMBL13245797 0.70 PIK3CD (0.45) KMT2APIK3CDTRPV1KCNQ3KCNQ2
SCHEMBL10127241 0.69 KIT (0.35) PIK3CDTRPV1
SCHEMBL10995605 0.67 MEN1 (0.70) MEN1KMT2AGAASMN1; SMN2TP53
SCHEMBL15029575 0.67 KMT2A (0.65) MEN1KMT2AGAASMN1; SMN2PTGES
SCHEMBL2614898 0.66 KMT2A (0.57) MEN1KMT2AGAASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND WATERS TECHNOLOGIES CORPORATION (US) 2012-02-16 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 (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-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 MEN1 724/4885KMT2A 103/4885GAA 3821/4885

“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.