SCHEMBL4516744

SCHEMBL4516744

CC(=O)Nc1ccc(NC(N)=S)cn1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
PTK2 Q05397 1/20 0.54
CYP1A2 P05177 1/20 0.49
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 6/20 0.47
RAB9A P51151 6/20 0.47
NPC1 O15118 5/20 0.47
MAPT P10636 1/20 0.43
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
PIK3CA P42336 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL28286247 0.81 KMT2A (0.64) KMT2APTK2CYP1A2GAASMN1; SMN2
SCHEMBL10222640 0.81 PTK2 (0.59) KMT2APTK2CYP1A2GAASMN1; SMN2
SCHEMBL13002752 0.80 PTK2 (0.61) KMT2APTK2CYP1A2GAASMN1; SMN2
SCHEMBL5458028 0.79 SMN1; SMN2 (0.61) KMT2AGAASMN1; SMN2RAB9AMAPT
SCHEMBL13698179 0.78 PTK2 (0.59) KMT2APTK2CYP1A2GAASMN1; SMN2
SCHEMBL22501700 0.78 KMT2A (0.60) KMT2APTK2CYP1A2GAASMN1; SMN2
Acetamide SCHEMBL28546989 0.77 KDM4E (0.47) KMT2APTK2SMN1; SMN2RAB9ANPC1
SCHEMBL28765766 0.77 PTK2 (0.50) KMT2APTK2CYP1A2GAASMN1; SMN2
Hydrochloric Acid SCHEMBL28698696 0.77 KMT2A (0.58) KMT2APTK2CYP1A2GAASMN1; SMN2
SCHEMBL17315227 0.76 PTK2 (0.53) KMT2APTK2CYP1A2GAASMN1; SMN2

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-9150561-B2 Thiazole derivatives and use thereof MERCK SERONO S.A. (CH) 2015-10-06 US disclosed
US-20140228365-A1 THIAZOLE DERIVATIVES AND USE THEREOF MERCK SERONO S.A. (CH) 2014-08-14 US disclosed
US-8802861-B2 Thiazole derivatives and use thereof MERCK SERONO SA (CH) 2014-08-12 US disclosed
US-20090029998-A1 Thiazole Derivatives and Use Thereof APPLIED RESEARCH SYSTEM ARS HOLDING N.V. (NL) 2009-01-29 US disclosed
EP-1709019-B1 THIAZOLE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS (AN) 2007-08-08 EP 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 (2 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-20140228365-A1 THIAZOLE DERIVATIVES AND USE THEREOF PF4, TEC, PDGFRB KMT2A 4760/4885PTK2 144/4885CYP1A2 2522/4885
US-20090029998-A1 Thiazole Derivatives and Use Thereof PDGFRB, PDGFRA, TEC KMT2A 4737/4885PTK2 68/4885CYP1A2 2078/4885

“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.