SCHEMBL19354586

SCHEMBL19354586

O[C@@H](Cc1ccc(Cl)cc1)c1nnn[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.41
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TAAR1 Q96RJ0 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP2D6 P10635 2/20 0.33
RAB9A P51151 2/20 0.33
USP2 O75604 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL19354511 1.00 SLC6A4 (0.41) SLC6A4SLC6A2SLC6A3SMN1; SMN2PPARG
SCHEMBL19354261 0.82 IDO1 (0.43) L3MBTL1CYP1A2IDO1
SCHEMBL19354535 0.82 IDO1 (0.43) L3MBTL1CYP1A2IDO1
SCHEMBL11299343 0.79 EPHX1 (0.40) SLC6A4SLC6A2SLC6A3PPARGPPARA
SCHEMBL17250967 0.77 GABBR2 (0.43) PPARGPPARAL3MBTL1MEN1KMT2A
SCHEMBL11293974 0.76 SLC6A4 (0.37) SLC6A4SLC6A2SLC6A3PPARGPPARA
SCHEMBL19354584 0.74 HTR2A (0.45) SLC6A4MEN1KMT2ACYP2D6CYP1A2
SCHEMBL19354510 0.74 HTR2A (0.45) SLC6A4MEN1KMT2ACYP2D6CYP1A2
SCHEMBL4959455 0.73 CYP1A2 (0.42) SLC6A4SLC6A2SLC6A3SMN1; SMN2PPARG
SCHEMBL19354585 0.70 GAA (0.36) SLC6A4SLC6A2SLC6A3MEN1KMT2A

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-9765064-B1 Alpha-hydroxy-beta-azido-tetrazoles CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-09-19 US disclosed
US-20170260171-A1 ALPHA-HYDROXY-BETA-AZIDO-TETRAZOLES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-09-14 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-20170260171-A1 ALPHA-HYDROXY-BETA-AZIDO-TETRAZOLES CYP8B1, HSD3B1, HSD17B1 SLC6A4 3252/4885SLC6A2 3947/4885SLC6A3 4140/4885

“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.