SCHEMBL18179632

SCHEMBL18179632

Cc1ncn(C(=O)N(C)C)n1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
SCN4A P35499 1/20 0.34
DPP4 P27487 1/20 0.33
BCHE P06276 2/20 0.33
ACHE P22303 1/20 0.33
LIPE Q05469 1/20 0.33
MGLL Q99685 4/20 0.32
TRPV1 Q8NER1 1/20 0.31
DAGLA Q9Y4D2 1/20 0.30
TSHR P16473 1/20 0.30
P2RX4 Q99571 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL18176975 0.77 DPP4 (0.34) SCN4ADPP4
SCHEMBL9204118 0.76 SCN4A (0.32) SCN4ADPP4BCHEACHELIPE
SCHEMBL11376332 0.76 ACHE (0.36) KMT2ASCN4ADPP4BCHEACHE
SCHEMBL5380486 0.73 DPP4 (0.42) SCN4ADPP4
SCHEMBL5381803 0.71 RORC (0.38) ALDH1A1BCHEACHELIPEMGLL
SCHEMBL5384803 0.70 KMT2A (0.44) ALDH1A1KMT2ADPP4BCHEACHE
SCHEMBL5384749 0.70 DPP4 (0.40) DPP4DAGLA
SCHEMBL5385568 0.68 TSHR (0.44) ALDH1A1KMT2ATSHRMAPT
SCHEMBL9506852 0.68 NOS1 (0.50) ALDH1A1KMT2ASCN4ABCHEACHE
SCHEMBL5376197 0.67 DPP4 (0.40) DPP4

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
EP-3082807-B1 THIAZOLE-SUBSTITUTED AMINOHETEROARYLS AS SPLEEN TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME (US) 2018-07-04 EP disclosed
US-9783531-B2 Thiazole-substituted aminoheteroaryls as spleen tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-10-10 US disclosed
US-20160311813-A1 THIAZOLE-SUBSTITUTED AMINOHETEROARYLS AS SPLEEN TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-10-27 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-20160311813-A1 THIAZOLE-SUBSTITUTED AMINOHETEROARYLS AS SPLEEN TYROSINE KINASE INHIBITORS SYK, TYRO3, BTK ALDH1A1 3386/4885KMT2A 1128/4885SCN4A 3119/4885

“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.