SCHEMBL14106915

SCHEMBL14106915

CN1C(=O)c2ccc(Oc3ccc4c(c3)C(=O)N(c3ccc(Oc5ccc(C(c6ccc(Oc7ccc(N8C(=O)c9ccc(Oc%10ccc%11c(c%10)C(=O)N(C)C%11=O)cc9C8=O)cc7)cc6)(C(F)(F)F)C(F)(F)F)cc5)cc3)C4=O)cc2C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.50
PKM P14618 1/20 0.48
MEN1 O00255 8/20 0.46
KMT2A Q03164 8/20 0.46
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 2/20 0.46
HTT P42858 2/20 0.45
ESR1 P03372 1/20 0.43
MAPT P10636 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA9 Q16790 3/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
POLB P06746 2/20 0.41
MAPK1 P28482 1/20 0.41
MCHR1 Q99705 1/20 0.40
CA2 P00918 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL25969185 0.96 MEN1 (0.52) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL25969188 0.96 MEN1 (0.52) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL25969156 0.92 MEN1 (0.48) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL1104522 0.92 MEN1 (0.46) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL30829232 0.91 MEN1 (0.47) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL1962793 0.91 MEN1 (0.47) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL21973674 0.90 BRD4 (0.47) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL12204981 0.89 MEN1 (0.44) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL13461010 0.88 BRD4 (0.52) BRD4PKMMEN1KMT2AALDH1A1
SCHEMBL13461076 0.88 BRD4 (0.52) BRD4PKMMEN1KMT2AALDH1A1

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-7404312-B2 Humidity-sensitive element for humidity sensor NIPPON SOKEN, INC. (JP) 2008-07-29 US disclosed