SCHEMBL30130809

SCHEMBL30130809

CCOC(=O)NC(=S)Nc1ccccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.57
LMNA P02545 3/20 0.56
HPGD P15428 2/20 0.56
ALOX15 P16050 1/20 0.56
HSD17B10 Q99714 1/20 0.56
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
MAPT P10636 5/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
KDM4E B2RXH2 2/20 0.50
GAA P10253 1/20 0.49
TSHR P16473 1/20 0.49
PPARG P37231 1/20 0.48
NCOA2 Q15596 1/20 0.48
NCOA1 Q15788 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL23727249 1.00 ALDH1A1 (0.57) ALDH1A1LMNAHPGDALOX15HSD17B10
Thiophanate SCHEMBL29398343 0.90 ALDH1A1 (0.70) ALDH1A1LMNAHPGDALOX15HSD17B10
Thiophanate SCHEMBL20842 0.90 ALDH1A1 (0.70) ALDH1A1LMNAHPGDALOX15HSD17B10
Thiophanate SCHEMBL7449541 0.88 ALDH1A1 (0.68) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL12336304 0.85 ALDH1A1 (0.64) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL11694452 0.85 ALDH1A1 (0.79) ALDH1A1LMNAHPGDALOX15HSD17B10
Thiophanate SCHEMBL10922494 0.85 ALDH1A1 (0.79) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL23727265 0.85 EPHX1 (0.65) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL1189632 0.85 ALDH1A1 (0.77) ALDH1A1LMNAHPGDKMT2AMEN1
SCHEMBL11835690 0.84 ALDH1A1 (0.62) ALDH1A1LMNAHPGDALOX15HSD17B10

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
EP-4100008-A1 PYRROLO [2,3-B]PYRIDINE-3-CARBOXAMIDE COMPOSITIONS AND METHODS FOR AMELIORATING HEARING LOSS The Rockefeller University (US) 2022-12-14 EP disclosed