SCHEMBL12299530

SCHEMBL12299530

CC(=O)Nc1cc(Cl)sc1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.37
ALOX15 P16050 2/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MAPT P10636 4/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
HTT P42858 1/20 0.35
DYRK1A Q13627 1/20 0.35

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
SCHEMBL18549676 0.77 HSD17B10 (0.42) HSD17B10KDM4EALDH1A1ALOX15GAA
SCHEMBL23412775 0.74 KDM4E (0.47) HSD17B10KDM4EALDH1A1ALOX15GAA
SCHEMBL4953227 0.72 DYRK1A (0.38) HSD17B10KDM4EALDH1A1ALOX15GAA
SCHEMBL12247516 0.71 MAPT (0.58) KDM4EALDH1A1GAATSHRMAPT
SCHEMBL7471720 0.68 PTK2 (0.42) HSD17B10KDM4EALDH1A1ALOX15GAA
SCHEMBL13706019 0.67
SCHEMBL6305183 0.67
SCHEMBL1466497 0.66
SCHEMBL7058277 0.66 CA1 (0.54) HSD17B10KDM4EALDH1A1ALOX15CA1
SCHEMBL20422013 0.66 MAPT (0.51) HSD17B10KDM4EALDH1A1ALOX15MAPT

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-20110237599-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-09-29 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-20110237599-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE HRH4, HRH3, HRH2 HSD17B10 3443/4885KDM4E 1897/4885ALDH1A1 1909/4885

“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.