SCHEMBL11684709

SCHEMBL11684709

CN(c1ccc(Oc2ccccc2)c(S(=O)(=O)O)c1)S(=O)(=O)c1cc(Cl)c(N)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 5/20 0.49
▸ POLB P06746 3/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ DUSP3 P51452 1/20 0.37
▸ PTPN5 P54829 1/20 0.37
▸ PTPN11 Q06124 1/20 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
SCHEMBL11686057 0.87 PGR (0.51) PGRPOLBRXFP1L3MBTL1MEN1
SCHEMBL11681883 0.86 ALDH1A1 (0.41) PGRMEN1KMT2AKDM4EALDH1A1
SCHEMBL11680118 0.83 SREBF1 (0.42) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL11680640 0.77 PGR (0.57) PGRPOLBRXFP1L3MBTL1MEN1
SCHEMBL11657083 0.76 ALDH1A1 (0.47) PGRPOLBMEN1KMT2AKDM4E
SCHEMBL11682666 0.75 KDM4E (0.45) PGRPOLBMEN1KMT2AKDM4E
Methane SCHEMBL11681369 0.75 ALDH1A1 (0.46) PGRPOLBMEN1KMT2AKDM4E
Methane SCHEMBL11682364 0.74 KDM4E (0.44) PGRPOLBMEN1KMT2AKDM4E
SCHEMBL11742164 0.74 CYP1A2 (0.50) PGRPOLBRXFP1L3MBTL1MEN1
SCHEMBL11683078 0.73 SMN1; SMN2 (0.45) PGRPOLBRXFP1L3MBTL1MEN1

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-4055557-A MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-10-25 — — US disclosed
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