SCHEMBL22701211

SCHEMBL22701211

CCCc1ncsc1CCN

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
HRH2 P25021 2/20 0.32
HRH1 P35367 2/20 0.32
HRH4 Q9H3N8 2/20 0.32
HRH3 Q9Y5N1 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PDE4D Q08499 1/20 0.30
PDE3A Q14432 1/20 0.30
PDE10A Q9Y233 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
SCHEMBL16502343 0.82 KDM4E (0.39) CYP1A2KDM4EMEN1ALDH1A1LMNA
SCHEMBL7613003 0.78 KDM4E (0.37) CYP1A2KDM4EMEN1ALDH1A1LMNA
SCHEMBL12179151 0.78 KDM4E (0.39) CYP1A2KDM4EMEN1ALDH1A1LMNA
SCHEMBL9710262 0.76 TSHR (0.39) MEN1ALDH1A1LMNAKMT2AHRH3
SCHEMBL12866934 0.76 KDM4E (0.35) CYP1A2KDM4EMEN1ALDH1A1LMNA
SCHEMBL1250888 0.74 MEN1 (0.37) CYP1A2KDM4EMEN1ALDH1A1LMNA
SCHEMBL12881346 0.74 ALDH1A1 (0.34) CYP1A2KDM4EMEN1ALDH1A1LMNA
SCHEMBL3091821 0.74
Bromide SCHEMBL15757177 0.72 ALDH1A1 (0.62) CYP1A2KDM4EMEN1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL7445751 0.72 ALDH1A1 (0.62) CYP1A2KDM4EMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200369658-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2020-11-26 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-20200369658-A1 NOVEL COMPOUNDS UCHL1, UCHL3, UCHL5 CYP1A2 2383/4885KDM4E 178/4885MEN1 2215/4885

“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.