SCHEMBL3102896

SCHEMBL3102896

O=C(O)Cc1cnc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.57
RAB9A P51151 1/20 0.54
CFTR P13569 1/20 0.52
KDM4E B2RXH2 3/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
FAAH O00519 2/20 0.49
KDR P35968 1/20 0.49
PDGFRB P09619 1/20 0.49
PDGFRA P16234 1/20 0.49
AKR1B1 P15121 2/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47

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
SCHEMBL29750532 1.00 MGAM (0.57) MGAMRAB9ACFTRKDM4EKMT2A
SCHEMBL12505006 0.85 MGAM (0.57) MGAMRAB9ACFTRKDM4EALDH1A1
SCHEMBL529902 0.85 MGAM (0.51) MGAMRAB9ACFTRKDM4EKMT2A
SCHEMBL2846347 0.83 MGAM (0.54) MGAMRAB9ACFTRFAAHKDR
SCHEMBL6276150 0.83 PDGFRB (0.49) MGAMRAB9ACFTRKDM4EKMT2A
Hydrochloric Acid SCHEMBL3867467 0.82 MGAM (0.53) MGAMRAB9ACFTRKDM4EFAAH
SCHEMBL6597946 0.82 CYP1A2 (0.52) MGAMRAB9ACFTRKDM4EKMT2A
SCHEMBL6239112 0.81 KDM4E (0.55) MGAMRAB9AKDM4EKMT2AMEN1
SCHEMBL5199025 0.81 CYP1A2 (0.60) MGAMRAB9ACFTRFAAHHDAC3
SCHEMBL5856432 0.81 CYP1A2 (0.52) MGAMRAB9ACFTRKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025243208-A2 PROCESS FOR THE PREPARATION AND/OR PURIFICATION OF POLYETHYLENE GLYCOL AND ITS DERIVATIVES, OBTAINED PRODUCT AND USES THEREOF HOVIONE - FARMACIÊNCIA, SA (PT) 2025-11-27 WO claimed
CN-117003553-A Corrosion-resistant composite refractory material and preparation method thereof 济源市耐火炉业有限公司 2023-11-07 CN claimed
CN-113248421-B Preparation method of nifedipine 合肥立方制药股份有限公司 2022-03-08 CN claimed
CN-113248421-A Preparation method of nifedipine 合肥立方制药股份有限公司 2021-08-13 CN claimed
CN-112939748-A Method for preparing deuterated compound through decarboxylation and deuteration of carboxylic acid 中国科学院大连化学物理研究所 2021-06-11 CN claimed
CN-112867504-A Novel control switch 葛兰素史克知识产权开发有限公司 2021-05-28 CN claimed
US-10806734-B2 Functional cure of retroviral infection KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2020-10-20 US claimed
CN-108396325-B Water-soluble weldable nickel protective agent 广州天至环保科技有限公司 2020-07-03 CN claimed
CN-111253304-A Preparation method of nifedipine 合肥立方制药股份有限公司 2020-06-09 CN claimed
WO-2020078925-A1 NOVEL CONTROL SWITCH GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-04-23 WO claimed
CN-108396325-A A kind of solderable nickel protective agent of water solubility 广州天至环保科技有限公司 2018-08-14 CN claimed
CN-105143190-A Substituted naphthyridine and quinoline compounds as MAO inhibitors DART NEUROSCIENCE LLC 2015-12-09 CN claimed
CN-1694873-A Vanilloid receptor ligands and their use in treatments AMGEN INC (US) 2005-11-09 CN claimed
EP-0633261-B1 QUINOLINE-3-ACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF YOSHITOMI PHARMACEUTICAL (JP) 1999-04-21 EP claimed
US-5543420-A ALDOSE REDUCTASE INHIBITORS; ANTIDIABETIC AGENTS; PREVENTION OF ACCUMULATION OF SORBITOL AND GALACTITOL IN MAMMALIAN TISSUE THE GREEN CROSS CORPORATION (JP) 1996-08-06 US claimed
CN-1102040-A Quinoline-3-acetic acid derivative, process for producing the same, and use thereof GREEN CROSS CORP (JP) 1995-04-26 CN claimed
EP-0633261-A1 QUINOLINE-3-ACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF THE GREEN CROSS CORPORATION (JP) 1995-01-11 EP claimed
WO-2025243208-A2 PROCESS FOR THE PREPARATION AND/OR PURIFICATION OF POLYETHYLENE GLYCOL AND ITS DERIVATIVES, OBTAINED PRODUCT AND USES THEREOF HOVIONE - FARMACIÊNCIA, SA (PT) 2025-11-27 WO disclosed
WO-1993009132-A1 HIV PROTEASE INHIBITORS CONTAINING GUANIDINE SMITHKLINE BEECHAM CORPORATION (US) 1993-05-13 WO disclosed
CN-85106674-A The preparation method of 2-hydroxy quinoline carboxylic acid derivatives 1986-07-16 CN disclosed