SCHEMBL22316

SCHEMBL22316

B(Oc1cccc(OCc2ccccc2)c1)Oc1cccc(OCc2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.66
CYP4F2 P78329 1/20 0.62
CYP4A11 Q02928 1/20 0.62
BCHE P06276 3/20 0.57
MAOA P21397 1/20 0.56
NR4A2 P43354 1/20 0.56
ALOX5 P09917 1/20 0.55
LCK P06239 1/20 0.53
GRM5 P41594 1/20 0.50
CCNB2 O95067 1/20 0.50
CDK1 P06493 1/20 0.50
CDK4 P11802 1/20 0.50
CCNB1 P14635 1/20 0.50
CCND1 P24385 1/20 0.50
CCNB3 Q8WWL7 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMPD1 P17405 1/20 0.50
SPHK2 Q9NRA0 1/20 0.49
SPHK1 Q9NYA1 1/20 0.49

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
SCHEMBL1268719 0.88 MAOB (0.81) MAOBCYP4F2CYP4A11BCHEMAOA
SCHEMBL15425251 0.86 CYP4F2 (0.63) MAOBCYP4F2CYP4A11BCHEMAOA
SCHEMBL23989 0.84 MAOB (0.60) MAOBMAOANR4A2MEN1KMT2A
SCHEMBL22875 0.83 MAOB (0.68) MAOBBCHEMEN1KMT2A
SCHEMBL21409 0.83 MAOB (0.61) MAOBMAOANR4A2
SCHEMBL22564 0.83 MAOB (0.64) MAOBBCHESMPD1SPHK2
SCHEMBL28237963 0.82 MAOB (0.72) MAOBCYP4F2CYP4A11BCHEMAOA
SCHEMBL5329319 0.82 MAOB (0.72) MAOBCYP4F2CYP4A11BCHEMAOA
SCHEMBL28182081 0.82 MAOB (0.79) MAOBCYP4F2CYP4A11BCHEMAOA
SCHEMBL306550 0.82 LMNA (0.64) MAOBBCHEMAOANR4A2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240293553-A1 P-SELECTIN INHIBITORS AND USES THEREOF BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2024-09-05 US disclosed
WO-2023049265-A1 P-SELECTIN INHIBITORS AND USES THEREOF BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2023-03-30 WO disclosed
CN-113861188-B Pyrazolo [3,4-b ] pyridine derivative, preparation method thereof and application thereof as HPK1 inhibitor 杭州医学院 2023-02-28 CN disclosed
CN-108884083-B Benzo [ B ] furans as bromodomain inhibitors 葛兰素史克知识产权第二有限公司 2022-02-25 CN disclosed
CN-113861188-A Pyrazolo [3,4-b ] pyridine derivative, preparation method thereof and application thereof as HPK1 inhibitor 杭州医学院 2021-12-31 CN disclosed
CN-108368107-B Fused heterocyclic compounds as S1P modulators 艾伯维公司 2021-11-26 CN disclosed
US-11008570-B2 3′ end caps for RNAi agents for use in RNA interference NOVARTIS AG (CH) 2021-05-18 US disclosed
EP-3722277-A2 3'END CAPS FOR RNA-INTERFERRING AGENTS FOR USE IN RNA Novartis AG (CH) 2020-10-14 EP disclosed
CN-111163774-A Bacterial efflux pump inhibitors 罗格斯新泽西州立大学 2020-05-15 CN disclosed
EP-3052464-B1 3'END CAPS FOR RNA-INTERFERRING AGENTS FOR USE IN RNA INTERFERENCE NOVARTIS AG (CH) 2020-04-15 EP disclosed
WO-2007070556-A2 N-(6-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. (US) 2007-06-21 WO disclosed
WO-2007056170-A2 PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES BAYER HEALTHCARE AG (DE) 2007-05-18 WO disclosed
WO-2007040438-A2 NOVEL IMIDAZO [4,5 -B] PYRIDINE DERIVATIVES AS INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 FOR USE IN THE TREATMENT OF DEMENTIA AND NEURODEGENERATIVE DISORDERS ASTRAZENECA AB (SE) 2007-04-12 WO disclosed
US-20070072901-A1 1-Amino-isoquinoline derivatives for the treatment of diseases associated with inappropriate alk5 GLAXO GROUP LIMITED (GB) 2007-03-29 US disclosed
EP-1689718-A1 1-AMINO-ISOQUINOLINE DERIVATIVES FOR THE TREATMENT OF DISEASES ASSOCIATED WITH INAPPROPRIATE ALK5 ACTIVITY GLAXO GROUP LIMITED (GB) 2006-08-16 EP disclosed
WO-2005049577-A1 1-AMINO-ISOQUINOLINE DERIVATIVES FOR THE TREATMENT OF DISEASES ASSOCIATED WITH INAPPROPRIATE ALK5 GLAXO GROUP LIMITED (GB) 2005-06-02 WO disclosed
EP-0838461-B1 Substituted 2,3-aryl-benzothiophene compounds having estrogenic activity LILLY CO ELI (US) 2003-09-03 EP disclosed
US-6121293-A SUCH AS 2-(4-METHOXYPHENYL)-3-(3-(2-(1-PIPERIDINYL)ETHOXY)PHENYL)-6 -METHOXYBENZO(B)THIOPHENE HYDROCHLORIDE; FOR TREATING OSTEOPOROSIS, HYPERLIPIDEMIA, AND ESTROGEN-DEPENDENT CANCER ELI LILLY AND COMPANY (US) 2000-09-19 US disclosed
US-5843940-A Benzothiophene compounds, compositions, and method ELI LILLY AND COMPANY (US) 1998-12-01 US disclosed
EP-0838461-A2 Substituted 2,3-aryl-benzothiophene compounds having estrogenic activity ELI LILLY AND COMPANY (US) 1998-04-29 EP 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 (3 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-20240293553-A1 P-SELECTIN INHIBITORS AND USES THEREOF SELP, SELPLG, SELE MAOB 1787/4885CYP4F2 2737/4885CYP4A11 3078/4885
US-11008570-B2 3′ end caps for RNAi agents for use in RNA interference RNGTT, NSUN2, NSUN3 MAOB 4294/4885CYP4F2 4816/4885CYP4A11 4879/4885
US-20070072901-A1 1-Amino-isoquinoline derivatives for the treatment of diseases associated with inappropriate alk5 ALK, NPR3, CBR3 MAOB 2506/4885CYP4F2 1326/4885CYP4A11 660/4885

“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.