SCHEMBL19782985

SCHEMBL19782985

CCOC(=O)c1sc(Nc2nccc(C)n2)nc1-c1ncccc1C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 13/20 0.51
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 2/20 0.43

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
SCHEMBL19782992 0.93 DHODH (0.56) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL15993418 0.86 DHODH (0.53) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL19782993 0.85 DHODH (0.47) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL27039803 0.83 DHODH (0.50) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL29601738 0.83 DHODH (0.50) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL19783118 0.80 DHODH (0.48) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL15993447 0.80 DHODH (0.54) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL15993345 0.78 DHODH (0.58) DHODHMAPTMEN1KMT2ALMNA
SCHEMBL15993448 0.77 DHODH (0.53) DHODHMAPTALDH1A1MEN1KMT2A
SCHEMBL19783114 0.77 ALDH1A1 (0.65) DHODHMAPTALDH1A1MEN1KMT2A

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 DHODH 329/4885MAPT 307/4885ALDH1A1 571/4885
US-20190241552-A1 SUBSTITUTED AMINOTHIAZOLES ABAT, AADAT, BCAT1 DHODH 329/4885MAPT 307/4885ALDH1A1 571/4885

“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.