SCHEMBL14451206

SCHEMBL14451206

Cc1ccc(N=Nc2cc(SOO)ccc2S(=O)(=O)O)c2cc(SOOO)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.41
▸ CYP1A2 P05177 2/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ THRB P10828 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ APP P05067 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ SNCA P37840 1/20 0.33
▸ BRCA1 P38398 1/20 0.33

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
SCHEMBL14451199 0.91 PTPN11 (0.40) PTPN11CYP1A2ALDH1A1MEN1THRB
SCHEMBL14503632 0.86 PTPN11 (0.40) PTPN11CYP1A2ALDH1A1MEN1THRB
SCHEMBL14503631 0.81 PTPN11 (0.43) PTPN11ALDH1A1MEN1THRBKMT2A
SCHEMBL14451197 0.78 PTPN11 (0.38) PTPN11ALDH1A1MEN1KMT2AMAPT
SCHEMBL13419025 0.73 PTPN11 (0.40) PTPN11RECQL
SCHEMBL12052556 0.73 PTPN11 (0.40) PTPN11ALDH1A1MAPT
SCHEMBL13298506 0.73 PTPN11 (0.38) PTPN11CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL14469720 0.73 SENP3 (0.48) CYP1A2ALDH1A1MEN1THRBKMT2A
SCHEMBL13802980 0.73 PTPN11 (0.47) PTPN11CYP1A2MEN1KMT2AKDM4E
SCHEMBL13949394 0.72 MEN1 (0.40) PTPN11CYP1A2ALDH1A1MEN1THRB

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-7250079-B2 Coloring composition and inkjet recording method FUJIFILM CORPORATION (JP) 2007-07-31 — — US disclosed
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