SCHEMBL11523693

SCHEMBL11523693

CCN(c1ccc(NC(=O)OC(C)S(=O)(=O)c2ccccc2)c(C)c1)C(C)NS(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
THRB P10828 1/20 0.38
OXTR P30559 1/20 0.36
AVPR1A P37288 1/20 0.36
HTT P42858 3/20 0.36
MAPK1 P28482 3/20 0.36
GFER P55789 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP2C19 P33261 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
LMNA P02545 3/20 0.35
HSD17B10 Q99714 2/20 0.35
NPC1 O15118 1/20 0.35
ALOX15 P16050 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35
GRK2 P25098 1/20 0.35
DNMT1 P26358 1/20 0.35

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
SCHEMBL11525252 0.85 MAPT (0.41) MAPTTHRBOXTRAVPR1AHTT
SCHEMBL9453020 0.75 MAPT (0.44) MAPTTHRBHTTALDH1A1CYP2C19
SCHEMBL8597481 0.75 MAPT (0.40) MAPTTHRBHTTMAPK1GFER
SCHEMBL9633381 0.75 IGLV6-57 (0.37) MAPTTHRBHTTMAPK1GFER
SCHEMBL10518294 0.70 TP53 (0.47) MAPTMAPK1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL793227 0.69 S100B (0.49) MAPTTHRBHTTALDH1A1LMNA
SCHEMBL9847596 0.69 S100B (0.49) MAPTTHRBHTTALDH1A1LMNA
Sulfuric Acid SCHEMBL6545764 0.69 S100B (0.46) MAPTTHRBHTTALDH1A1LMNA
Water SCHEMBL9591233 0.68 S100B (0.48) MAPTTHRBHTTALDH1A1LMNA
Hydrochloric Acid SCHEMBL9188528 0.68 S100B (0.48) MAPTTHRBHTTALDH1A1LMNA

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-4157915-A (2-BENZENESULFONYL)-ETHOXYCARBONYLAMINO-ANILINE COMPOUND AS THE PRECURSOR FUJI PHOTO FILM CO., LTD. (JP) 1979-06-12 US disclosed