SCHEMBL28770872

SCHEMBL28770872

CCC(=O)OC(c1cc2ccccc2[nH]1)S(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 4/20 0.43
▸ PDGFRA P16234 4/20 0.43
▸ ALOX5 P09917 1/20 0.41
▸ KDM4E B2RXH2 6/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ BCAT1 P54687 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ MAPT P10636 2/20 0.38
▸ ADAMTS4 O75173 1/20 0.38
▸ DAO P14920 1/20 0.38
▸ SRD5A2 P31213 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ IDO1 P14902 1/20 0.36
▸ TSHR P16473 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
SCHEMBL27733782 0.89 KDM4E (0.43) PDGFRBPDGFRAKDM4ETP53ALDH1A1
SCHEMBL27713340 0.88 ATM (0.41) PDGFRBPDGFRAKDM4ELMNAALDH1A1
SCHEMBL27713332 0.88 MEN1 (0.42) KDM4ELMNABCAT1ALDH1A1SMN1; SMN2
SCHEMBL27713445 0.88 BCAT1 (0.45) PDGFRBPDGFRABCAT1ALDH1A1MAPT
SCHEMBL27713316 0.87 HRH3 (0.37) PDGFRBPDGFRABCAT1ALDH1A1HPGD
SCHEMBL27733691 0.86 ELANE (0.41) PDGFRBPDGFRALMNAL3MBTL1ALDH1A1
SCHEMBL27733647 0.85 PTGDR2 (0.38) KDM4ETP53L3MBTL1HSD17B10HPGD
SCHEMBL27713329 0.85 AR (0.39) PDGFRBPDGFRALMNAL3MBTL1ALDH1A1
SCHEMBL27733871 0.83 KDM4E (0.44) PDGFRBPDGFRAKDM4EBCAT1MAPT
SCHEMBL27713298 0.82 GPR27 (0.34) PDGFRBPDGFRA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101248044-B Indole compounds FOURNIER LAB SA 2012-05-30 — — CN disclosed
CN-101248044-A Novel indole compounds FOURNIER LAB SA (FR) 2008-08-20 — — CN disclosed
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