SCHEMBL14434860

SCHEMBL14434860

CCc1ccc(CSc2ccc(NS(=O)(=O)c3ccc(C(C)C)c(C(=O)O)c3)cn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
MAPT P10636 3/20 0.41
METAP2 P50579 2/20 0.41
POLB P06746 2/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
XBP1 P17861 1/20 0.41
PABPC1 P11940 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.39
CXCR2 P25025 2/20 0.39
UCHL1 P09936 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN5 P54829 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NAMPT P43490 2/20 0.39
MCL1 Q07820 1/20 0.38

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
SCHEMBL14434456 0.94 L3MBTL1 (0.44) ALDH1A1MAPTPOLBLMNAMEN1
SCHEMBL14434450 0.94 CXCR2 (0.47) ALDH1A1MAPTMETAP2HTTLMNA
SCHEMBL14434873 0.93 L3MBTL1 (0.43) ALDH1A1MAPTMETAP2HTTLMNA
SCHEMBL14434863 0.91 PTPN5 (0.46) ALDH1A1MAPTPOLBHTTLMNA
SCHEMBL14434869 0.90 KMT2A (0.42) ALDH1A1MAPTMEN1KMT2APKM
SCHEMBL14434499 0.90 POLB (0.42) ALDH1A1MAPTPOLBHTTLMNA
SCHEMBL14434449 0.90 TRPM8 (0.43) ALDH1A1POLBMEN1KMT2APKM
SCHEMBL14434501 0.89 CXCR2 (0.48) ALDH1A1MAPTPOLBHTTLMNA
SCHEMBL14434454 0.89 CXCR2 (0.41) ALDH1A1MAPTMETAP2LMNAPABPC1
SCHEMBL5318868 0.88 ALDH1A1 (0.51) ALDH1A1MAPTMETAP2POLBHTT

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
WO-2007091140-A1 SUBSTITUTED PHENYLSULFAMOYL COMPOUNDS AS PPAR AGONISTS PFIZER PRODUCTS INC. (US) 2007-08-16 WO disclosed