SCHEMBL9972885

SCHEMBL9972885

Cn1c(=O)c2c(C(C)(C)C)snc2n(C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 2/20 0.37
ADORA2A P29274 3/20 0.37
ALDH1A1 P00352 5/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ADORA2B P29275 2/20 0.36
LMNA P02545 2/20 0.36
JAK2 O60674 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
PAX8 Q06710 1/20 0.36

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
SCHEMBL9972908 0.72 KMT2A (0.44) KDM4EKMT2AADORA2AALDH1A1RXFP1
SCHEMBL1689509 0.72 KDM4E (0.47) KDM4EKMT2AADORA2AALDH1A1ADORA2B
SCHEMBL14972716 0.71 KDM4E (0.36) KDM4EKMT2AADORA2AALDH1A1RXFP1
SCHEMBL9972905 0.69 TRPA1 (0.32) KDM4EADORA2AADORA2B
SCHEMBL15472439 0.68 ADORA2A (0.43) KDM4EKMT2AADORA2ARXFP1ADORA2B
SCHEMBL1689535 0.68 ADORA2B (0.40) KDM4EKMT2AADORA2AALDH1A1RXFP1
SCHEMBL3716133 0.68 ADORA2B (0.38) KDM4EKMT2AADORA2AALDH1A1RXFP1
SCHEMBL9972894 0.68 KDM4E (0.58) KDM4EALDH1A1LMNAJAK2HPGD
SCHEMBL13190508 0.67 ALOX15 (0.42) KDM4EALDH1A1ADORA2BLMNAHPGD
SCHEMBL9972876 0.66 KDM4E (0.37) KDM4EKMT2AADORA2AALDH1A1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073955-B2 2-amino-4-arylthiazole compounds as TRPA1 antagonists GLENMARK PHARMACEUTICALS, S.A. (CH) 2015-07-07 US disclosed
US-8889862-B2 2-amino-4-arylthiazole compounds as TRPA1 antagonists GLENMARK PHARMACEUTICALS, S.A. (CH) 2014-11-18 US disclosed
US-20140051667-A1 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AS TRPA1 ANTAGONISTS GLENMARK PHARMACEUTICALS, S.A. (CH) 2014-02-20 US disclosed
US-20140045865-A1 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AS TRPA1 ANTAGONISTS GLENMARK PHARMACEUTICALS, S.A. (CH) 2014-02-13 US disclosed
US-20120157411-A1 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AS TRPAI ANTAGONISTS GLENMARK PHARMACEUTICALS, S.A. (CH) 2012-06-21 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 (3 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-20120157411-A1 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AS TRPAI ANTAGONISTS TRPA1, TRPV1, TRPV2 KDM4E 4035/4885KMT2A 2406/4885ADORA2A 81/4885
US-20140045865-A1 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AS TRPA1 ANTAGONISTS TRPA1, TRPV1, TRPV2 KDM4E 4154/4885KMT2A 2625/4885ADORA2A 63/4885
US-20140051667-A1 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AS TRPA1 ANTAGONISTS TRPA1, TRPV1, TRPV2 KDM4E 4154/4885KMT2A 2625/4885ADORA2A 63/4885

“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.