SCHEMBL17863733

SCHEMBL17863733

CC(=O)c1cn2cc(Cl)sc2n1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.33
TPH1 P17752 3/20 0.32
TPH2 Q8IWU9 3/20 0.32
WDR91 A4D1P6 1/20 0.32
RAB9A P51151 4/20 0.31
NPC1 O15118 3/20 0.31
MAPT P10636 2/20 0.31
PTGS2 P35354 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
PKM P14618 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HRH4 Q9H3N8 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL16426550 0.84 PTGS1 (0.42) TPH1TPH2WDR91RAB9ANPC1
SCHEMBL17863729 0.80 CYP19A1 (0.45) TPH1TPH2WDR91RAB9ANPC1
SCHEMBL17863736 0.76 LMNA (0.33)
SCHEMBL17863730 0.76 PKM (0.33) PKM
SCHEMBL17863728 0.76 CCNE1 (0.31)
SCHEMBL18658780 0.75 WDR91 (0.38) TPH1TPH2WDR91RAB9ANPC1
SCHEMBL17863720 0.75 DAO (0.32)
SCHEMBL1665689 0.72 TPH1 (0.31) TPH1TPH2MAPTSMN1; SMN2
SCHEMBL19291869 0.69 TPH1 (0.31) TPH1TPH2SMN1; SMN2
SCHEMBL17454368 0.69 TP53 (0.49) RAB9ANPC1MAPTKDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9512144-B2 Imidazothiazole sufonamides as nematicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-12-06 US disclosed
US-20160176898-A1 IMIDAZOTHIAZOLE SUFONAMIDES AS NEMATICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-06-23 US 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 (1 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-20160176898-A1 IMIDAZOTHIAZOLE SUFONAMIDES AS NEMATICIDES NISCH, TST, SULT1E1 KDM1A 3330/4885TPH1 2350/4885TPH2 2168/4885

“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.