SCHEMBL4517015

SCHEMBL4517015

NC(=S)NCCn1cncn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.38
NAMPT P43490 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
FPR3 P25089 1/20 0.36
FPR2 P25090 1/20 0.36
MAPT P10636 2/20 0.35
CYP19A1 P11511 2/20 0.34
FDPS P14324 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL22212153 0.77
SCHEMBL23609328 0.75 EGLN3 (0.44) EGLN3LOXL2NAMPTCYP1A2CYP3A4
SCHEMBL18072248 0.75 EGLN3 (0.53) EGLN3LOXL2NAMPTCYP1A2CYP3A4
SCHEMBL20445070 0.75 EGLN3 (0.53) EGLN3LOXL2NAMPTCYP1A2CYP3A4
SCHEMBL23875821 0.73 EGLN3 (0.37) EGLN3LOXL2NAMPTCYP1A2CYP3A4
SCHEMBL3633388 0.73 EGLN3 (0.38) EGLN3LOXL2NAMPTCYP1A2CYP3A4
SCHEMBL23875663 0.72
SCHEMBL23875762 0.71 EGLN3 (0.36) EGLN3LOXL2NAMPTCYP1A2CYP3A4
SCHEMBL19755640 0.71 EGLN3 (0.49) EGLN3LOXL2NAMPTCYP1A2CYP3A4
Thiourea SCHEMBL8177690 0.71 EGLN3 (0.42) EGLN3MAPTCYP19A1FDPSSMN1; 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 7 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
EP-1709019-A2 THIAZOLE DERIVATIVES AND USE THEREOF Applied Research Systems ARS Holding N.V. (AN) 2006-10-11 EP disclosed
WO-2005068444-A2 THIAZOLE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-07-28 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 (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 EGLN3 4374/4885LOXL2 2804/4885NAMPT 2049/4885
US-20090029998-A1 Thiazole Derivatives and Use Thereof PDGFRB, PDGFRA, TEC EGLN3 4514/4885LOXL2 1981/4885NAMPT 3494/4885

“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.