SCHEMBL3098901

SCHEMBL3098901

Oc1ccc(-c2ccc(O)nc2)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KMT2A Q03164 3/20 0.44
HSD17B1 P14061 2/20 0.40
HSD17B2 P37059 2/20 0.40
PIK3CD O00329 1/20 0.36
ESR2 Q92731 2/20 0.35
MKNK1 Q9BUB5 2/20 0.35
MKNK2 Q9HBH9 2/20 0.35
USP7 Q93009 2/20 0.35
ESR1 P03372 1/20 0.35
MAPT P10636 3/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP2A6 P11509 2/20 0.33
USP2 O75604 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL30619390 1.00 MEN1 (0.44) MEN1NPC1RAB9AKMT2AHSD17B1
SCHEMBL1585520 0.87 NPC1 (0.50) MEN1NPC1RAB9AKMT2AHSD17B1
SCHEMBL2325516 0.85 LTA4H (0.47) MEN1NPC1RAB9AKMT2AMAPT
SCHEMBL19461191 0.85 ALDH1A1 (0.56) MEN1NPC1RAB9AKMT2APIK3CD
SCHEMBL17795051 0.85 EGLN1 (0.44) MEN1NPC1RAB9AKMT2AMAPT
SCHEMBL903918 0.83 WNT3A (0.40) MEN1NPC1RAB9AKMT2A
SCHEMBL20448329 0.83 MEN1 (0.39) MEN1NPC1RAB9AKMT2AHSD17B1
SCHEMBL17809709 0.80 EGLN1 (0.44) MEN1NPC1RAB9AKMT2AMAPT
SCHEMBL20646149 0.80 MMP3 (0.57) RIPK1MAP4K4
SCHEMBL31737439 0.80 ALDH5A1 (0.46) MEN1NPC1RAB9AKMT2AMKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10800717-B2 Palladium-based supported hydrogenation catalyst, and preparation method and application thereof PETROCHINA COMPANY LIMITED (CN) 2020-10-13 US claimed
US-10800717-B2 Palladium-based supported hydrogenation catalyst, and preparation method and application thereof PETROCHINA COMPANY LIMITED (CN) 2020-10-13 US disclosed
CN-105732265-B Carbon two selective hydrogenation method in sequential separation process 中国石油天然气股份有限公司 2019-07-05 CN disclosed
CN-105732269-B Selective hydrogenation method for carbon two-fraction in sequential separation process 中国石油天然气股份有限公司 2019-04-09 CN disclosed
CN-105732270-B Front hydrogenation method for trace acetylene in methanol-to-olefin device 中国石油天然气股份有限公司 2019-04-05 CN disclosed
CN-105727946-B Preparation method of palladium-silver supported hydrogenation catalyst 中国石油天然气股份有限公司 2019-02-15 CN disclosed
CN-105727990-B Preparation method of palladium-copper supported hydrogenation catalyst 中国石油天然气股份有限公司 2019-02-15 CN disclosed
CN-105749909-B Preparation method of palladium-lead supported hydrogenation catalyst 中国石油天然气股份有限公司 2019-01-18 CN disclosed
CN-105732272-B Selective hydrogenation method for trace acetylene in methanol-to-olefin device 中国石油天然气股份有限公司 2018-10-16 CN disclosed
CN-105749910-B Palladium-lead supported hydrogenation catalyst 中国石油天然气股份有限公司 2018-10-16 CN disclosed
CN-105732283-A Method for selective hydrofining of ethylene 中国石油天然气股份有限公司 2016-07-06 CN disclosed
CN-105732265-A Carbon two selective hydrogenation method in sequential separation process 中国石油天然气股份有限公司 2016-07-06 CN disclosed
CN-105732261-A Selective hydrogenation method for trace acetylene in methanol-to-olefin device 中国石油天然气股份有限公司 2016-07-06 CN disclosed
CN-105732286-A Selective hydrogenation method of carbon three-fraction 中国石油天然气股份有限公司 2016-07-06 CN disclosed
CN-105732274-A Ethylene selective hydrogenation refining method 中国石油天然气股份有限公司 2016-07-06 CN disclosed
US-20100270537-A1 OPTOELECTRONIC DEVICES AND ORGANIC COMPOUNDS USED THEREIN GENERAL ELECTRIC COMPANY (US) 2010-10-28 US disclosed
EP-1076648-B1 METHOD FOR THE CATALYTIC PRODUCTION OF SUBSTITUTED DIPYRIDYL DERIVATIVES MERCK PATENT GMBH (DE) 2006-07-12 EP disclosed
US-6500956-B1 CONVERTING SUBSTITUTED HALOPYRIDINE DERIVATIVES WITH BASE AND REDUCING AGENT IN PRESENCE OF A PALLADIUM CATALYST AXIVA GMBH (DE) 2002-12-31 US disclosed
EP-1076648-A1 METHOD FOR THE CATALYTIC PRODUCTION OF SUBSTITUTED DIPYRIDYL DERIVATIVES Axiva GmbH (DE) 2001-02-21 EP disclosed
WO-1999055675-A1 METHOD FOR THE CATALYTIC PRODUCTION OF SUBSTITUTED DIPYRIDYL DERIVATIVES AXIVA GMBH (DE) 1999-11-04 WO 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-20100270537-A1 OPTOELECTRONIC DEVICES AND ORGANIC COMPOUNDS USED THEREIN AOC3, C3AR1, AOC2 MEN1 2141/4885NPC1 745/4885RAB9A 2097/4885

“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.