SCHEMBL5718104

SCHEMBL5718104

Cc1cccc(Nc2ccc(N)c3c2C(=O)c2ccccc2C3=O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY4 P51582 7/20 0.62
▸ P2RY12 Q9H244 6/20 0.62
▸ P2RY2 P41231 5/20 0.62
▸ P2RY6 Q15077 2/20 0.62
▸ ADORA2A P29274 2/20 0.60
▸ FGR P09769 1/20 0.51
▸ PIM1 P11309 1/20 0.51
▸ MAOA P21397 1/20 0.51
▸ CSNK1A1 P48729 1/20 0.51
▸ CSNK1D P48730 1/20 0.51
▸ DYRK1A Q13627 1/20 0.51
▸ HIPK2 Q9H2X6 1/20 0.51
▸ CSNK1G1 Q9HCP0 1/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ MMP14 P50281 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.48
▸ MAPT P10636 3/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48

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
SCHEMBL11576581 0.92 P2RY4 (0.63) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL14255728 0.89 P2RY4 (0.61) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL17342960 0.89 P2RY12 (0.60) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL10415363 0.86 GNG2 (0.62) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL29448193 0.86 P2RY4 (0.58) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL717132 0.86 P2RY4 (0.58) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL30508524 0.86 P2RY4 (0.58) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL10809232 0.85 P2RY4 (0.60) P2RY4P2RY12P2RY2ADORA2AFGR
SCHEMBL169365 0.84 ADORA2A (0.63) P2RY4P2RY12P2RY2P2RY6ADORA2A
SCHEMBL30918998 0.84 ADORA2A (0.63) P2RY4P2RY12P2RY2P2RY6ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110506080-B Process for printing textile fibre materials containing cellulose 亨斯迈先进材料(瑞士)有限公司 2021-09-17 — — CN disclosed
US-11008700-B2 Process for printing cellulose containing textile fibre material HUNTSMAN INTERNATIONAL LLC (US) 2021-05-18 — — US disclosed
US-20200102699-A1 Process for Printing Cellulose Containing Textile Fibre Material HUNTSMAN INTERNATIONAL LLC 2020-04-02 — — US disclosed
EP-3601438-A1 PROCESS FOR PRINTING CELLULOSE CONTAINING TEXTILE FIBRE MATERIAL Huntsman Advanced Materials (Switzerland) GmbH (CH) 2020-02-05 — — EP disclosed
CN-110506080-A Process for printing textile fibre materials containing cellulose HUNTSMAN ADV MAT SWITZERLAND 2019-11-26 — — CN disclosed
WO-2018177652-A1 PROCESS FOR PRINTING CELLULOSE CONTAINING TEXTILE FIBRE MATERIAL HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2018-10-04 — — WO disclosed
US-9388206-B2 Chromophores with perfluoroalkyl substituents BASF SE (DE) 2016-07-12 — — US disclosed
US-20140103635-A1 CHROMOPHORES WITH PERFLUOROALKYL SUBSTITUENTS BASF SE (DE) 2014-04-17 — — US disclosed
EP-0927747-B1 ANTHRAPYRIDONE COMPOUNDS, WATER-BASE INK COMPOSITION, AND ARTICLES COLORED THEREWITH NIPPON KAYAKU KK (JP) 2006-07-19 — — EP disclosed
CN-1095861-C Anthrapyridone compounds, water-base ink compsn. and articles colored therewith NIPPON KAYAKU KK (JP) 2002-12-11 — — CN disclosed
US-6152969-A INK JET PRINTING OF PAPER, CLOTH, FIBERS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-11-28 — — US disclosed
CN-1230203-A Anthrapyridone compounds, water-base ink compsn. and articles colored therewith NIPPON KAYAKU KK (JP) 1999-09-29 — — CN disclosed
EP-0927747-A1 ANTHRAPYRIDONE COMPOUNDS, WATER-BASE INK COMPOSITION, AND ARTICLES COLORED THEREWITH NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1999-07-07 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140103635-A1 CHROMOPHORES WITH PERFLUOROALKYL SUBSTITUENTS RBP4, RBP1, FABP5 P2RY4 1804/4885P2RY12 3958/4885P2RY2 2889/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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