SCHEMBL4528665

SCHEMBL4528665

CC/C=C\c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.54
IDO1 P14902 2/20 0.52
PAM P19021 1/20 0.52
MAOB P27338 1/20 0.50
RELA Q04206 2/20 0.48
SIGMAR1 Q99720 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CHAT P28329 1/20 0.44
NPC1 O15118 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL14961 1.00 HTR2A (0.54) HTR2AIDO1PAMMAOBRELA
SCHEMBL455862 1.00 HTR2A (0.54) HTR2AIDO1PAMMAOBRELA
SCHEMBL178030 1.00 HTR2A (0.54) HTR2AIDO1PAMMAOBRELA
Benzene SCHEMBL1226476 1.00 HTR2A (0.54) HTR2AIDO1PAMMAOBRELA
Benzene SCHEMBL1226473 1.00 HTR2A (0.54) HTR2AIDO1PAMMAOBRELA
SCHEMBL28363766 0.97 HTR2A (0.52) HTR2AIDO1PAMMAOBRELA
Hydrogen Sulfide SCHEMBL28289964 0.97 HTR2A (0.52) HTR2AIDO1PAMMAOBRELA
Butane SCHEMBL28785259 0.95 HTR2A (0.50) HTR2AIDO1PAMMAOBRELA
Water SCHEMBL28173279 0.95 HTR2A (0.50) HTR2AIDO1PAMMAOBRELA
Biphenyl SCHEMBL28843797 0.93 HTR2A (0.48) HTR2AIDO1PAMMAOBRELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111978142-B Method for isomerizing cis-olefin into trans-olefin 厦门大学 2021-06-15 CN claimed
CN-111978142-A Method for isomerizing cis-olefin into trans-olefin 厦门大学 2020-11-24 CN claimed
CN-117801625-A High-heat-conductivity resin coating and preparation method thereof 杭州元恒新材料科技有限公司 2024-04-02 CN disclosed
EP-3532459-B1 LSD1 INHIBITORS AND MEDICAL USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2023-08-02 EP disclosed
WO-2022079696-A1 METHOD OF DESIGNING ADSORPTION COLUMNS SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2022-04-21 WO disclosed
CN-111978142-B Method for isomerizing cis-olefin into trans-olefin 厦门大学 2021-06-15 CN disclosed
CN-111978142-A Method for isomerizing cis-olefin into trans-olefin 厦门大学 2020-11-24 CN disclosed
EP-3286172-B1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2019-06-12 EP disclosed
WO-2018106984-A1 MARKERS FOR PERSONALIZED CANCER TREATMENT WITH LSD1 INHIBITORS CONSTELLATION PHARMACEUTICALS, INC. (US) 2018-06-14 WO disclosed
WO-2018081343-A1 LSD1 INHIBITORS AND MEDICAL USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. (US) 2018-05-03 WO disclosed
WO-2018081342-A1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. (US) 2018-05-03 WO disclosed
CN-1214860-C Composition and its preparation method KURARAY CO (JP) 2005-08-17 CN disclosed
US-6929787-B2 Composite and manufacturing method thereof KURARAY CO., LTD. (JP) 2005-08-16 US disclosed
CN-1381307-A Composition and its preparation method KURARAY CO (JP) 2002-11-27 CN disclosed
EP-1232788-A2 Composite product and manufacturing method thereof Kuraray Co., Ltd. (JP) 2002-08-21 EP disclosed
US-20020111269-A1 Composite and manufacturing method thereof KURARAY CO. LTD. (JP) 2002-08-15 US disclosed
US-4822937-A CATALYTIC ALKYLATION, THEN DEHYDROISOMERIZATION BP CHEMICALS LIMITED (GB) 1989-04-18 US disclosed
EP-0196165-B1 PROCESS FOR THE PRODUCTION OF ISOBUTYLBENZENES BP Chemicals Limited (GB) 1988-05-04 EP disclosed
EP-0196165-A1 Process for the production of isobutylbenzenes BP Chemicals Limited (GB) 1986-10-01 EP disclosed
WO-1986004892-A1 PROCESS FOR THE PRODUCTION OF ISOBUTYLBENZENES BP CHEMICALS LIMITED (GB) 1986-08-28 WO disclosed