SCHEMBL454642

SCHEMBL454642

NC(=O)C1CC2C=CC1C2

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
THRB P10828 1/20 0.38
EPHX2 P34913 4/20 0.37
ALDH1A1 P00352 5/20 0.36
KMT2A Q03164 2/20 0.35
RAB9A P51151 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
GAA P10253 1/20 0.34
POLB P06746 2/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
ESR2 Q92731 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 1/20 0.34
EPHX1 P07099 1/20 0.31
HSD11B1 P28845 1/20 0.31

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
SCHEMBL6959803 1.00 KDM4E (0.59) KDM4ELMNATHRBEPHX2ALDH1A1
Trifluoroacetic Acid SCHEMBL15156223 0.87 KDM4E (0.47) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL5892403 0.81 KDM4E (0.63) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL75505 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL5431682 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL24004713 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL21705290 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL900095 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL6161898 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1
SCHEMBL16898630 0.79 KDM4E (0.61) KDM4ELMNATHRBEPHX2ALDH1A1

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 230 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119859370-A Cycloolefin resin composition and composite material thereof 道生天合材料科技(上海)股份有限公司 2025-04-22 CN claimed
CN-114790260-B High-modulus, high-impact, wear-resistant and heat-resistant intrinsic flame-retardant polydicyclopentadiene engineering material and preparation method thereof 安徽建筑大学 2023-04-18 CN claimed
CN-114870064-A Photo-curing composite hydrogel containing contrast agent and preparation and use methods thereof 上海玮沐医疗科技有限公司 2022-08-09 CN claimed
CN-114790260-A High-modulus, high-impact, wear-resistant and heat-resistant intrinsic flame-retardant polydicyclopentadiene engineering material and preparation method thereof 安徽建筑大学 2022-07-26 CN claimed
CN-114478426-A Norbornene-type benzoxazine-containing monomer and preparation method thereof 中北大学 2022-05-13 CN claimed
CN-112225703-B Medicine for treating or preventing diseases related to LRRK2 kinase or abnormal LRRK2 mutant kinase activity 广州智睿医药科技有限公司 2022-03-11 CN claimed
US-9879110-B2 Block copolymers INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-01-30 US claimed
WO-2015038868-A1 FUSED BICYCLIC 2,4-DIAMINOPYRIMIDINE DERIVATIVES CEPHALON, INC. (US) 2015-03-19 WO claimed
EP-2809671-A1 IMIDAZO [4, 5 - B]PYRIDINE DERIVATIVES AS ALK AND JAK MODULATORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS Cephalon, Inc. (US) 2014-12-10 EP claimed
WO-2013116291-A1 IMIDAZO [4, 5 - B] PYRIDINE DERIVATIVES AS ALK AND JAK MODULATORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CEPHALON, INC. (US) 2013-08-08 WO claimed
EP-1446115-B1 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS MERCK FROSST CANADA LTD (CA) 2008-02-27 EP claimed
EP-1446115-A4 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS MERCK FROSST CANADA INC (CA) 2005-02-02 EP claimed
EP-1446115-A2 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS Merck Frosst Canada & Co. (CA) 2004-08-18 EP claimed
WO-2003041649-A2 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS MERCK FROSST CANADA & CO. (CA) 2003-05-22 WO claimed
US-4039491-A IMPACT STRENGTH, NORBORNENE DERIVATIVE CONTAINING POLAR GROUP JAPAN SYNTHETIC RUBBER CO., LTD. (JA) 1977-08-02 US claimed
US-4011386-A RING OPENING, POLYALKENAMERS JAPAN SYNTHETIC RUBBER CO., LTD. (JA) 1977-03-08 US claimed
CN-122037731-A Wear-resistant waterproof paint and preparation method thereof 广州和新实业有限公司 2026-05-15 CN disclosed
EP-4737513-A1 RUBBER COMPOSITION FOR TIRE, AND TIRE BRIDGESTONE CORPORATION (JP) 2026-05-06 EP disclosed
US-4011386-A RING OPENING, POLYALKENAMERS JAPAN SYNTHETIC RUBBER CO., LTD. (JA) 1977-03-08 US disclosed
US-4011386-A RING OPENING, POLYALKENAMERS JAPAN SYNTHETIC RUBBER CO., LTD. (JA) 1977-03-08 US disclosed