SCHEMBL10776660

SCHEMBL10776660

Nc1cccc(-c2cccc3c(=O)on(-c4cc5ccccc5[nH]4)c23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ MAOB P27338 2/20 0.37
▸ AURKA O14965 1/20 0.36
▸ CDK4 P11802 2/20 0.36
▸ CCND1 P24385 2/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PRKDC P78527 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ PRMT1 Q99873 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34

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
SCHEMBL722383 0.90 HPGD (0.40) BRD4MAOBCDK4CCND1PRKDC
SCHEMBL10621402 0.86 ATM (0.38) MAPTBRD4MAOBAURKAPARP1
SCHEMBL10776657 0.79 BRD4 (0.43) MAPTBRD4MAOBAURKAPARP1
SCHEMBL9180131 0.79 NPC1 (0.35) MAPTBRD4KDM4ENPC1ALDH1A1
SCHEMBL5667449 0.73 CDC25B (0.41) MAPTBRD4KDM4EHPGDSMN1; SMN2
SCHEMBL25199891 0.71 KDR (0.46) MAPTBRD4AURKAPARP1PIK3CB
SCHEMBL10337010 0.71 KDM4E (0.36) MAPTKDM4ENPC1ALDH1A1HPGD
SCHEMBL8438285 0.69 PARP1 (0.38) BRD4PARP1KDM4ENPC1ALDH1A1
SCHEMBL8776952 0.66 BRD4 (0.40) MAPTBRD4PARP1PRKDCKDM4E
SCHEMBL6360162 0.65 MAOA (0.54) MAPTBRD4AURKACDK4CCND1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4705776-A Recording material containing chromogenic 3,3-bisindolyl-4-azaphthalides CIBA-GEIGY CORPORATION (US) 1987-11-10 — — US disclosed
US-4668966-A PRESSURE- OR HEAT-SENSITIVE RECORDING CIBA-GEIGY CORPORATION (US) 1987-05-26 — — US disclosed
US-4587343-A COLOR FORMERS IN PRESSURE-SENSITIVE OR HEAT SENSITIVE RECORDING MATERIALS CIBA-GEIGY CORPORATION (US) 1986-05-06 — — US disclosed
US-4555569-A PRESSURE AND HEAT SENSITIVE ELEMENTS CIBA-GEIGY CORPORATION (US) 1985-11-26 — — US disclosed
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