SCHEMBL24445700

SCHEMBL24445700

CC(=O)c1cccc(N(CC(=O)O)S(C)(=O)=O)c1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.64
TSHR P16473 1/20 0.64
GAA P10253 1/20 0.64
MAPT P10636 2/20 0.59
ALDH1A1 P00352 4/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
ALOX15 P16050 1/20 0.57
CYP2C19 P33261 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 3/20 0.49
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL4928405 0.85 KMT2A (0.58) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL1883486 0.85 GAA (0.60) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL24445723 0.85 GAA (0.63) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL6744201 0.83 KMT2A (0.69) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL23269311 0.82 KMT2A (0.58) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL2558736 0.81 SMN1; SMN2 (0.61) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL697566 0.81 SMN1; SMN2 (0.73) KMT2ATSHRGAAMAPTALDH1A1
SCHEMBL21625227 0.81 ALDH1A1 (0.64) KMT2ATSHRMAPTALDH1A1SMN1; SMN2
SCHEMBL16384063 0.78 ALDH1A1 (0.65) TSHRALDH1A1CYP3A4CYP2D6CYP2C9
SCHEMBL4933383 0.78 SMN1; SMN2 (0.57) KMT2ATSHRGAAMAPTSMN1; SMN2

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-4000609-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING BONE DISEASES Industry Foundation of Chonnam National University (KR) 2022-05-25 EP disclosed