SCHEMBL995901

SCHEMBL995901

OCc1ccnc(-c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 1/20 0.53
RECQL P46063 1/20 0.50
LOXL2 Q9Y4K0 2/20 0.49
PDCD1 Q15116 1/20 0.47
CD274 Q9NZQ7 1/20 0.47
PRKCI P41743 1/20 0.46
FYN P06241 2/20 0.46
NOTUM Q6P988 1/20 0.44
FFAR1 O14842 1/20 0.44
KDM1A O60341 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
TSHR P16473 1/20 0.43
WNT3A P56704 1/20 0.42
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL4772524 0.96 LOXL2 (0.50) ASIC3RECQLLOXL2PDCD1CD274
SCHEMBL27822958 0.85 ASIC3 (0.50) ASIC3LOXL2PDCD1CD274NOTUM
SCHEMBL1411265 0.83 RECQL (0.61) RECQLLOXL2PDCD1CD274PRKCI
SCHEMBL29393772 0.83 RECQL (0.61) RECQLLOXL2PDCD1CD274PRKCI
SCHEMBL27822961 0.82 ASIC3 (0.47) ASIC3LOXL2PDCD1CD274FFAR1
SCHEMBL11776617 0.82 PDCD1 (0.62) ASIC3RECQLLOXL2PDCD1CD274
SCHEMBL4772393 0.81 RECQL (0.56) RECQLLOXL2NOTUMLMNAMAPT
SCHEMBL14310545 0.81 LOXL2 (0.50) ASIC3RECQLLOXL2PRKCIKDM1A
SCHEMBL4492835 0.81 RECQL (0.47) RECQLLOXL2FYNHTR1ANPC1
SCHEMBL4764104 0.81 RECQL (0.47) RECQLLOXL2PDCD1CD274KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118165038-A Cyclic metal ruthenium nitrosyl complex, preparation method and application as NO release photosensitizer 中南民族大学 2024-06-11 CN claimed
EP-3750890-B1 ALKOXYBENZO-FIVE-MEMBERED (SIX-MEMBERED) HETEROCYCLIC AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF SHIJIAZHUANG YILING PHARMACEUTICAL CO LTD (CN) 2026-04-01 EP disclosed
WO-2025007113-A2 MITOCHONDRIAL COMPLEX I INHIBITORS WITH REDUCED PHOSPHODIESTERASE INHIBITION OHIO STATE INNOVATION FOUNDATION (US) 2025-01-02 WO disclosed
CN-118165038-A Cyclic metal ruthenium nitrosyl complex, preparation method and application as NO release photosensitizer 中南民族大学 2024-06-11 CN disclosed
US-11396504-B2 Alkoxybenzo-five-membered (six-membered) heterocyclic amine compound and pharmaceutical use thereof FUDAN UNIVERSITY (CN) 2022-07-26 US disclosed
US-20210032230-A1 Alkoxybenzo-five-membered (six-membered) heterocyclic amine compound and pharmaceutical use thereof SHIJIAZHUANG YILING PHARMACEUTICAL CO., LTD (CN) 2021-02-04 US disclosed
US-20210032230-A1 Alkoxybenzo-five-membered (six-membered) heterocyclic amine compound and pharmaceutical use thereof SHIJIAZHUANG YILING PHARMACEUTICAL CO., LTD (CN) 2021-02-04 US disclosed
EP-3750890-A1 ALKOXYBENZO-FIVE-MEMBERED (SIX-MEMBERED) HETEROCYCLIC AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF Fudan University (CN) 2020-12-16 EP disclosed
EP-3750890-A1 ALKOXYBENZO-FIVE-MEMBERED (SIX-MEMBERED) HETEROCYCLIC AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF Fudan University (CN) 2020-12-16 EP disclosed
WO-2019154047-A1 ALKOXYBENZO-FIVE-MEMBERED (SIX-MEMBERED) HETEROCYCLIC AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF 复旦大学 2019-08-15 WO disclosed
WO-2011001089-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-01-06 WO disclosed
CN-100491352-C Asymmetrical cyclic diamine compound KOWA CO (JP) 2009-05-27 CN disclosed
US-7342116-B2 Process for producing heterocyclic aldehyde KOEI CHEMICAL CO., LTD. (JP) 2008-03-11 US disclosed
EP-1400513-B1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND KOWA CO (JP) 2008-01-09 EP disclosed
EP-1400513-B1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND KOWA CO (JP) 2008-01-09 EP disclosed
US-20050124807-A1 oxidation of a hetero alcohol in presence od an 2,2,6,6-teraalkylpiperidin-1-oxy comound KOEI CHEMICAL CO., LTD. (JP) 2005-06-09 US disclosed
CN-1520402-A Unsymmetrical cyclic diamine compound ������������ʽ���� 2004-08-11 CN disclosed
EP-1400513-A1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND Kowa Co., Ltd. (JP) 2004-03-24 EP disclosed
US-6552188-B2 Inhibit cell adhesion and cell infiltration; useful treating asthma, allergies, rheumatic diseases, arteriosclerosis, and inflammation; 2-(3,4,5-trimethoxyphenyl),4-((4-substituted piperazin-1-yl)methyl)pyridine compounds KOWA CO., LTD. (JP) 2003-04-22 US disclosed
US-20030022887-A1 Unsymmetrical cyclic diamine compound KOWA CO., LTD. (JP) 2003-01-30 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 (4 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-20050124807-A1 oxidation of a hetero alcohol in presence od an 2,2,6,6-teraalkylpiperidin-1-oxy comound ADH1C, ADH1A, AOX1 ASIC3 3322/4885RECQL 4638/4885LOXL2 173/4885
US-20030022887-A1 Unsymmetrical cyclic diamine compound H1-0, DDAH1, AOC1 ASIC3 446/4885RECQL 1199/4885LOXL2 4426/4885
US-20210032230-A1 Alkoxybenzo-five-membered (six-membered) heterocyclic amine compound and pharmaceutical use thereof LIPC, GPR119, VIP ASIC3 1449/4885RECQL 3691/4885LOXL2 479/4885
US-11396504-B2 Alkoxybenzo-five-membered (six-membered) heterocyclic amine compound and pharmaceutical use thereof LIPC, GPR119, VIP ASIC3 1449/4885RECQL 3691/4885LOXL2 479/4885

“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.