SCHEMBL11071673

SCHEMBL11071673

C=CCn1cnc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 5/20 0.62
▸ PRKD3 O94806 1/20 0.50
▸ MAP4K4 O95819 1/20 0.50
▸ FRK P42685 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ CSNK1A1 P48729 1/20 0.50
▸ CSNK1D P48730 1/20 0.50
▸ GSK3B P49841 1/20 0.50
▸ PRKD2 Q9BZL6 1/20 0.50
▸ MAP4K5 Q9Y4K4 1/20 0.50
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ HDAC3 O15379 1/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC7 Q8WUI4 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45

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
SCHEMBL11330525 0.79 MAP4K4 (0.56) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL11335769 0.79 PTGS2 (0.51) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL4912081 0.78 MAPK14 (0.63) MAP4K4MAPK9CSNK1A1CSNK1DMAP4K5
SCHEMBL4805174 0.77 PTGS2 (0.63) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL9698769 0.76 PTGS2 (0.61) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL10615042 0.75 PTGS2 (0.59) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL8475690 0.75 PTGS2 (0.59) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL8480092 0.75 PTGS2 (0.59) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL8656772 0.74 MAP4K4 (0.62) PTGS2PRKD3MAP4K4FRKMAPK9
SCHEMBL27980049 0.73 PTGS2 (0.58) PTGS2PRKD3MAP4K4FRKMAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4264695-A LAMINATED ELECTROCONDUCTIVE SUPPORTS RICOH CO., LTD. (JP) 1981-04-28 — — US claimed
CN-109415452-B Method for producing highly reactive isobutene homo-or copolymers 巴斯夫欧洲公司 2021-10-26 — — CN disclosed
US-10975175-B2 Process for preparing high-reactivity isobutene homo- or copolymers BASF SE (DE) 2021-04-13 — — US disclosed
EP-3487891-B1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2020-04-29 — — EP disclosed
US-20190284313-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2019-09-19 — — US disclosed
EP-3487891-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2019-05-29 — — EP disclosed
EP-2812418-B1 IMIDAZOLIUM SALTS AS ADDITIVES FOR FUELS AND COMBUSTIBLES BASF SE (DE) 2018-11-21 — — EP disclosed
WO-2018015306-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2018-01-25 — — WO disclosed
US-9062266-B2 Imidazolium salts as additives for fuels BASF SE (DE) 2015-06-23 — — US disclosed
EP-2812418-A1 IMIDAZOLIUM SALTS AS ADDITIVES FOR FUELS AND COMBUSTIBLES BASF SE (DE) 2014-12-17 — — EP disclosed
US-20130205654-A1 IMIDAZOLIUM SALTS AS ADDITIVES FOR FUELS BASF SE (DE) 2013-08-15 — — US disclosed
WO-2013117616-A1 IMIDAZOLIUM SALTS AS ADDITIVES FOR FUELS AND COMBUSTIBLES BASF SE (DE) 2013-08-15 — — WO disclosed
US-4451549-A Laminated photosensitive plate for electrophotography and process for preparation thereof MITA INDUSTRIAL CO., LTD. (JP) 1984-05-29 — — US disclosed
US-4264695-A LAMINATED ELECTROCONDUCTIVE SUPPORTS RICOH CO., LTD. (JP) 1981-04-28 — — US disclosed
US-3974167-A (7-Nitro-2-aza-9-fluorenylidene) malononitrile RICOH CO., LTD. (JA) 1976-08-10 — — US disclosed
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