SCHEMBL14546748

SCHEMBL14546748

Nc1cc(O)c(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2S(=O)(=O)O)cc1/N=N/c1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.40
▸ BRD4 O60885 1/20 0.40
▸ CREBBP Q92793 1/20 0.40
▸ THRB P10828 2/20 0.38
▸ PHLPP2 Q6ZVD8 1/20 0.37
▸ P2RX5 Q93086 2/20 0.35
▸ P2RX4 Q99571 2/20 0.35
▸ P2RX2 Q9UBL9 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ P2RY1 P47900 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ P2RX3 P56373 1/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ ENPP2 Q13822 3/20 0.35

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
SCHEMBL14546910 0.95 BRD4 (0.37) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL14546741 0.95 THRB (0.45) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL14546994 0.95 BRD4 (0.37) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL14546970 0.93 PHLPP2 (0.37) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL14546744 0.92 P2RX5 (0.38) THRBP2RX5P2RX4P2RX2ALDH1A1
SCHEMBL14546750 0.91 KDM4E (0.42) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL14547009 0.91 ENPP2 (0.36) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL2483843 0.89 BRD4 (0.37) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL2483846 0.89 BRD4 (0.37) TP53BRD4CREBBPTHRBPHLPP2
SCHEMBL14546952 0.88 SENP2 (0.34) TP53BRD4CREBBPTHRBPHLPP2

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-2007039573-A2 AZO REACTIVE DYES AND MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-04-12 — — WO disclosed
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