SCHEMBL19782384

SCHEMBL19782384

CC(C)OC(=O)c1sc(Nc2ncccn2)nc1-c1cnccn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
HTT P42858 2/20 0.38
RAB9A P51151 2/20 0.38
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
KDM4E B2RXH2 4/20 0.35
HPGD P15428 4/20 0.35
PPARG P37231 3/20 0.35
NCOA2 Q15596 3/20 0.35
NCOA1 Q15788 3/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
MAPT P10636 5/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
DHODH Q02127 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDR P35968 1/20 0.34
LIMK1 P53667 4/20 0.34
LIMK2 P53671 4/20 0.34

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
SCHEMBL19782395 0.90 CDC7 (0.40) ALDH1A1CDC7DBF4KDM4EMAPT
SCHEMBL19783003 0.87 ADORA3 (0.41) ALDH1A1KMT2AMEN1RAB9AKDM4E
SCHEMBL21245761 0.85 CDC7 (0.56) ALDH1A1KMT2AMEN1RAB9ACDC7
SCHEMBL19782389 0.84 DHODH (0.38) ALDH1A1KMT2AMEN1HTTRAB9A
SCHEMBL19782390 0.84 DHODH (0.36) ALDH1A1KMT2AMEN1HTTRAB9A
SCHEMBL19782988 0.83 CDC7 (0.46) ALDH1A1KMT2AMEN1RAB9ACDC7
SCHEMBL19782897 0.76 CDC7 (0.38) ALDH1A1KMT2AMEN1HTTRAB9A
SCHEMBL15993076 0.75 NPC1 (0.48) ALDH1A1KMT2AHTTRAB9AKDM4E
SCHEMBL19782716 0.74 CDC7 (0.39) ALDH1A1KMT2AMEN1HTTRAB9A
SCHEMBL19782394 0.74 DHODH (0.38) KMT2AMEN1RAB9AKDM4EHPGD

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-10913734-B2 Substituted aminothiazoles BARUCH S. BLUMBERG INSTITUTE 2021-02-09 US disclosed
US-20190241552-A1 SUBSTITUTED AMINOTHIAZOLES BARUCH S. BLUMBERG INSTITUTE 2019-08-08 US disclosed
WO-2018013508-A1 SUBSTITUTED AMINOTHIAZOLES BARUCH S. BLUMBERG INSTITUTE (US) 2018-01-18 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-10913734-B2 Substituted aminothiazoles ABAT, AADAT, BCAT1 ALDH1A1 571/4885KMT2A 662/4885MEN1 2492/4885
US-20190241552-A1 SUBSTITUTED AMINOTHIAZOLES ABAT, AADAT, BCAT1 ALDH1A1 571/4885KMT2A 662/4885MEN1 2492/4885

“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.