SCHEMBL27733782

SCHEMBL27733782

CCC(=O)OC(c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ HSD17B10 Q99714 3/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PIN1 Q13526 1/20 0.41
▸ PDGFRB P09619 2/20 0.41
▸ PDGFRA P16234 2/20 0.41
▸ TP53 P04637 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ GHSR Q92847 3/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ DAO P14920 1/20 0.36
▸ USP2 O75604 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
SCHEMBL28770872 0.89 PDGFRB (0.43) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL27713340 0.88 ATM (0.41) KDM4EALDH1A1HSD17B10HPGDPDGFRB
SCHEMBL27713445 0.88 BCAT1 (0.45) ALDH1A1PDGFRBPDGFRAGAAFLT3
SCHEMBL27713332 0.88 MEN1 (0.42) KDM4EALDH1A1RAB9ASMN1; SMN2KMT2A
SCHEMBL27713316 0.87 HRH3 (0.37) ALDH1A1HPGDPDGFRBPDGFRAKMT2A
SCHEMBL27733691 0.86 ELANE (0.41) ALDH1A1RAB9AHPGDSMN1; SMN2PDGFRB
SCHEMBL27713329 0.85 AR (0.39) ALDH1A1RAB9ASMN1; SMN2PDGFRBPDGFRA
SCHEMBL27733871 0.83 KDM4E (0.44) KDM4EPDGFRBPDGFRAKMT2AGAA
SCHEMBL27733651 0.82 MMP2 (0.38) ALDH1A1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL27713298 0.81 GPR27 (0.34) PDGFRBPDGFRAKMT2A

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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