SCHEMBL11328593

SCHEMBL11328593

CCN(CCCS(=O)(=O)O)c1ccc(C=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.59
ALDH1A3 P47895 2/20 0.59
ALDH3A1 P30838 2/20 0.59
MEN1 O00255 7/20 0.43
KMT2A Q03164 7/20 0.43
L3MBTL1 Q9Y468 5/20 0.43
HPGD P15428 4/20 0.43
HSP90AA1 P07900 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 2/20 0.41
GAA P10253 2/20 0.41
CYP2A6 P11509 1/20 0.41
CYP2A13 Q16696 1/20 0.41
CNR2 P34972 1/20 0.40
MAPT P10636 7/20 0.38
LMNA P02545 2/20 0.38
GLA P06280 1/20 0.38
GFER P55789 1/20 0.38
POLB P06746 3/20 0.37

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
SCHEMBL6302951 0.84 CNR2 (0.47) ALDH1A1MEN1KMT2AL3MBTL1HPGD
SCHEMBL11152193 0.84 ALDH1A1 (0.51) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL15894604 0.83 ALDH1A1 (0.55) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL11838350 0.83 CYP2A6 (0.46) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL242391 0.83 KMT2A (0.46) ALDH1A1MEN1KMT2AL3MBTL1HPGD
Hydrochloric Acid SCHEMBL9660363 0.83 ALDH1A1 (0.50) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL8070020 0.82 ALDH1A1 (0.53) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL15364591 0.82 ALDH1A1 (0.74) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL5523437 0.81 KMT2A (0.45) ALDH1A1MEN1KMT2AL3MBTL1HPGD
SCHEMBL30848429 0.81 KMT2A (0.45) ALDH1A1MEN1KMT2AL3MBTL1HPGD

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-4268622-A Photographic light-sensitive materials having dyed layers FUJI PHOTO FILM CO., LTD. (JP) 1981-05-19 US disclosed