SCHEMBL26546136

SCHEMBL26546136

CN(c1cc(N2CCCCC2)ccc1I)S(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
MAPK1 P28482 3/20 0.39
POLB P06746 1/20 0.39
HTR6 P50406 2/20 0.39
TYK2 P29597 3/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALOX15 P16050 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 2/20 0.38
S100B P04271 2/20 0.36
GAA P10253 2/20 0.36
TERT O14746 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL26513075 0.86 MAPT (0.42) TSHRALDH1A1MAPTMAPK1MEN1
SCHEMBL24498535 0.84 MEN1 (0.48) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL26121387 0.83 MAPT (0.50) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL24497504 0.83 TSHR (0.40) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL26511011 0.82 MEN1 (0.46) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL26545858 0.82 TSHR (0.40) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL24498567 0.81 TSHR (0.39) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL26544208 0.79 TSHR (0.40) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL26511168 0.79 MAPT (0.39) TSHRALDH1A1MAPTMAPK1POLB
SCHEMBL26124496 0.79 HPGD (0.59) ALDH1A1MAPTMAPK1POLBMEN1

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-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 EP disclosed