SCHEMBL1483697

SCHEMBL1483697

CC(Cl)C(=O)Nc1ccc(C#N)cn1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
TMPRSS4 Q9NRS4 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.48
IDO1 P14902 2/20 0.46
DEGS1 O15121 1/20 0.45
MAPK1 P28482 1/20 0.44
USP30 Q70CQ3 1/20 0.44
EP300 Q09472 3/20 0.43
DYRK3 O43781 1/20 0.43
GSK3A P49840 1/20 0.43
GSK3B P49841 1/20 0.43
DYRK1A Q13627 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
STK17A Q9UEE5 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
GCK P35557 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL3060427 0.88 MEN1 (0.53) MEN1KMT2ATMPRSS4IDO1DEGS1
SCHEMBL1484026 0.88 MEN1 (0.53) MEN1KMT2ATMPRSS4IDO1DEGS1
SCHEMBL25990087 0.82 MEN1 (0.48) MEN1KMT2ATMPRSS4IDO1DEGS1
SCHEMBL1430551 0.80 KMT2A (0.57) MEN1KMT2ATMPRSS4L3MBTL1IDO1
SCHEMBL19116806 0.78 SMN1; SMN2 (0.51) MEN1KMT2ATMPRSS4L3MBTL1DEGS1
SCHEMBL3715011 0.78 MEN1 (0.58) MEN1KMT2ATMPRSS4IDO1DEGS1
SCHEMBL2323680 0.77 RAB9A (0.52) MEN1KMT2AMAPK1
SCHEMBL6610291 0.76 MEN1 (0.57) MEN1KMT2ATMPRSS4IDO1DEGS1
SCHEMBL17538666 0.76 MAPT (0.56) MEN1KMT2ATMPRSS4L3MBTL1IDO1
SCHEMBL1428781 0.76 USP30 (0.54) MEN1KMT2ATMPRSS4DEGS1USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314103-B2 Pyridyl derivatives, their preparation and use Piramal Enterprises Limited (IN) 2012-11-20 US disclosed
US-20110077252-A1 PYRIDYL DERIVATIVES, THEIR PREPARATION AND USE Piramal Enterprises Limited (IN) 2011-03-31 US disclosed
WO-2009019656-A1 PYRIDYL DERIVATIVES, THEIR PREPARATION AND USE PIRAMAL LIFE SCIENCES LIMITED (IN) 2009-02-12 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 (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-20110077252-A1 PYRIDYL DERIVATIVES, THEIR PREPARATION AND USE HIF1AN, HIF1A, MTOR MEN1 4391/4885KMT2A 3868/4885TMPRSS4 3294/4885

“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.