SCHEMBL19782983

SCHEMBL19782983

CCOC(=O)CCc1sc(Nc2ncccn2)nc1-c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
ALDH1A1 P00352 5/20 0.45
GAA P10253 4/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 3/20 0.43
KDM4E B2RXH2 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HTT P42858 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
DHODH Q02127 1/20 0.40
ADAMTS4 O75173 1/20 0.39
MMP14 P50281 1/20 0.39
ADAMTS13 Q76LX8 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
MAPK1 P28482 1/20 0.39
KDM6B O15054 1/20 0.39
KDM6A O15550 1/20 0.39
KDM4A O75164 1/20 0.39

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
SCHEMBL19783021 0.89 ALDH1A1 (0.49) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL19783019 0.86 ALDH1A1 (0.42) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL15993205 0.85 ALDH1A1 (0.41) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL19782984 0.85 ADAMTS5 (0.52) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL21221232 0.83 NPC1 (0.47) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL15993345 0.81 DHODH (0.58) MAPTMEN1KMT2ALMNAHPGD
SCHEMBL15993539 0.81 ALDH1A1 (0.41) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL15993383 0.79 HSD17B10 (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL15993497 0.79 NPC1 (0.39) MAPTGAAMEN1KMT2ALMNA
SCHEMBL19782714 0.79 ADORA2A (0.41) MAPTALDH1A1MEN1KMT2ALMNA

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 MAPT 307/4885ALDH1A1 571/4885GAA 3355/4885
US-20190241552-A1 SUBSTITUTED AMINOTHIAZOLES ABAT, AADAT, BCAT1 MAPT 307/4885ALDH1A1 571/4885GAA 3355/4885

“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.