SCHEMBL8432111

SCHEMBL8432111

NC1=NC(=O)c2ccc(C(=O)O)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.49
PTPRC P08575 2/20 0.47
POLB P06746 3/20 0.45
KMT2A Q03164 3/20 0.45
CSNK2A2 P19784 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
CSNK2A3 Q8NEV1 1/20 0.44
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
GABRA4 P48169 1/20 0.42
GABRE P78334 1/20 0.42

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
SCHEMBL3380503 0.77 TTR (0.55) TTRPTPRCPOLBKMT2AALDH1A1
SCHEMBL2976406 0.77 TTR (0.55) TTRPTPRCPOLBKMT2AALDH1A1
SCHEMBL8432114 0.75 F2 (0.36) KMT2AALDH1A1HPGDMEN1TDP1
SCHEMBL13196215 0.74 CDC25B (0.59) TTRPTPRCPOLBKMT2ACSNK2A2
SCHEMBL69805 0.71 PTPRC (0.72) TTRPTPRCPOLBKMT2ACA1
SCHEMBL68062 0.71 PTPRC (0.72) TTRPTPRCPOLBKMT2ACA1
Hydrochloric Acid SCHEMBL2097036 0.70 S100A4 (0.47) PTPRCKMT2AALDH1A1CA1CA2
SCHEMBL15900800 0.70 KDM4E (0.55) TTRPTPRCPOLBKMT2ACSNK2A2
SCHEMBL71021 0.70 TTR (0.88) TTRPTPRCPOLBKMT2ACSNK2A2
SCHEMBL598301 0.70 TTR (0.88) TTRPTPRCPOLBKMT2ACSNK2A2

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
EP-0847749-B1 Use of diiminoisoindoline or 3-aminoisoindolone derivatives for the dyeing of keratinic fibers and compositions containing them OREAL (FR) 1999-12-01 EP claimed