SCHEMBL820654

SCHEMBL820654

O=C1/C(=C/c2ccccc2)CCc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 1.00
MIF P14174 9/20 0.81
MAPT P10636 4/20 0.81
CYP19A1 P11511 3/20 0.77
PKM P14618 2/20 0.77
CYP11B2 P19099 1/20 0.77
MAPK1 P28482 1/20 0.77
MAOA P21397 1/20 0.72
ALDH1A1 P00352 1/20 0.70
KMT2A Q03164 1/20 0.70
CYP1A2 P05177 1/20 0.69
CASP3 P42574 2/20 0.68
RAB9A P51151 2/20 0.68
SENP8 Q96LD8 2/20 0.68
SENP7 Q9BQF6 2/20 0.68
SENP6 Q9GZR1 2/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
KDM4E B2RXH2 1/20 0.65
NPC1 O15118 1/20 0.65

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
SCHEMBL15153677 1.00 MAOB (1.00) MAOBMIFMAPTCYP19A1PKM
SCHEMBL29546087 1.00 MAOB (1.00) MAOBMIFMAPTCYP19A1PKM
SCHEMBL980327 1.00 MAOB (1.00) MAOBMIFMAPTCYP19A1PKM
SCHEMBL29546151 1.00 MAOB (1.00) MAOBMIFMAPTCYP19A1PKM
SCHEMBL29679848 1.00 MAOB (1.00) MAOBMIFMAPTCYP19A1PKM
SCHEMBL6958006 0.90 MIF (1.00) MAOBMIFMAPTCYP19A1PKM
SCHEMBL13203410 0.90 MAOB (0.81) MAOBMIFMAPTCYP19A1PKM
SCHEMBL14033869 0.90 MAOB (0.81) MAOBMIFMAPTCYP19A1PKM
SCHEMBL8548101 0.87 MAOB (0.77) MAOBMIFMAPTCYP19A1PKM
SCHEMBL6825622 0.87 CYP19A1 (1.00) MAOBMIFMAPTCYP19A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661407-B2 Process for the preparation of pyrylium salts COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2023-05-30 US disclosed
CN-112694449-B Asymmetric hydrogenation of ketone and alpha, beta-unsaturated ketone catalyzed by nonmetal catalyst 中国科学院化学研究所 2022-05-24 CN disclosed
CN-112694449-A Novel nonmetal catalyst for catalyzing asymmetric hydrogenation of ketone and alpha, beta-unsaturated ketone 中国科学院化学研究所 2021-04-23 CN disclosed
US-20210087158-A1 A PROCESS FOR THE PREPARATION OF PYRYLIUM SALTS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2021-03-25 US disclosed
US-RE48156-E1 Electronic device comprising an organic semiconducting material NOVALED GMBH (DE) 2020-08-11 US disclosed
US-10629822-B2 Organic electroluminescent material and organic optoelectronic device Shanghai Tianma AM-OLED Co., Ltd. (CN) 2020-04-21 US disclosed
US-20180105477-A1 A METHOD FOR PREPARING OPTICALLY ACTIVE CARBONYL COMPOUND ZHEJIANG NHU COMPANY LTD. (CN) 2018-04-19 US disclosed
US-20170256723-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2017-09-07 US disclosed
US-20170256723-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2017-09-07 US disclosed
US-9722183-B2 Display NOVALED GMBH (DE) 2017-08-01 US disclosed
US-20110054190-A1 CATALYST AND REACTION PROCESS JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-03-03 US disclosed
US-20110054190-A1 CATALYST AND REACTION PROCESS JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-03-03 US disclosed
US-7872029-B2 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states BOWEN J PHILLIP 2011-01-18 US disclosed
US-20100324338-A1 CATALYST FOR ASYMMETRIC HYDROGENATION TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-12-23 US disclosed
WO-2010140636-A1 ASYMMETRIC HYDROGENATION CATALYST 高砂香料工業株式会社 (JP) 2010-12-09 WO disclosed
US-20100190836-A1 Compounds, Screens, and Methods of Treatment PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2010-07-29 US disclosed
WO-2010066450-A1 A METHOD FOR PREPARING SULFUR-CONTAINING COMPOUNDS THE ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2010-06-17 WO disclosed
WO-2009096409-A1 CATALYST AND REACTION PROCESS JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-08-06 WO disclosed
US-20090018167-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states Robinson, Thomas Philip (US) 2009-01-15 US disclosed
US-7432303-B2 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states Bowen, J. Phillip (US) 2008-10-07 US 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 (9 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-20100324338-A1 CATALYST FOR ASYMMETRIC HYDROGENATION H1-0, H1-5, ADH5 MAOB 1483/4885MIF 1431/4885MAPT 2035/4885
US-20090018167-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, FLT4, VEGFA MAOB 2526/4885MIF 332/4885MAPT 1274/4885
US-20210087158-A1 A PROCESS FOR THE PREPARATION OF PYRYLIUM SALTS IPO5, SF3B5, CYP4F11 MAOB 2307/4885MIF 895/4885MAPT 2365/4885
US-20100190836-A1 Compounds, Screens, and Methods of Treatment NLN, HTRA2, CLN6 MAOB 874/4885MIF 2498/4885MAPT 233/4885
US-10629822-B2 Organic electroluminescent material and organic optoelectronic device OR10J3, RPS10, H1-10 MAOB 1215/4885MIF 771/4885MAPT 4084/4885
US-20110054190-A1 CATALYST AND REACTION PROCESS ME1, MAL2, ME2 MAOB 307/4885MIF 295/4885MAPT 4868/4885
US-20180105477-A1 A METHOD FOR PREPARING OPTICALLY ACTIVE CARBONYL COMPOUND TPSD1, QDPR, TALDO1 MAOB 19/4885MIF 2335/4885MAPT 573/4885
US-11661407-B2 Process for the preparation of pyrylium salts SF3B5, IPO5, CYP4F11 MAOB 2613/4885MIF 1345/4885MAPT 2455/4885
US-20170256723-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE OR10J3, OR51E2, RPS10 MAOB 1216/4885MIF 882/4885MAPT 4278/4885

“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.