SCHEMBL2149352

SCHEMBL2149352

O=c1[nH]c2ccc(F)cc2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 4/20 0.61
PPM1D O15297 1/20 0.54
OGT O15294 1/20 0.53
PDE3B Q13370 1/20 0.53
PDE3A Q14432 1/20 0.53
KDM4E B2RXH2 2/20 0.50
KMO O15229 1/20 0.50
CREBBP Q92793 1/20 0.50
ALDH1A1 P00352 1/20 0.50
NOS3 P29474 3/20 0.47
NOS2 P35228 3/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
ADRA2A P08913 1/20 0.47
TSHR P16473 1/20 0.47
THPO P40225 1/20 0.47
BLM P54132 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALPL P05186 1/20 0.45
GRIA1 P42261 1/20 0.45

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
SCHEMBL17260657 0.85 PDE3B (0.69) NOS1PPM1DOGTPDE3BPDE3A
SCHEMBL30567360 0.84 NOS1 (0.61) NOS1PPM1DOGTPDE3BPDE3A
SCHEMBL244162 0.84 NOS1 (0.61) NOS1PPM1DOGTPDE3BPDE3A
SCHEMBL4836194 0.78 MAOB (0.46) NOS1PPM1DOGTNOS3NOS2
SCHEMBL29891935 0.77 MAOA (0.61) KDM4EALDH1A1LMNA
SCHEMBL6590835 0.77 MAOB (0.45) KDM4EALDH1A1LMNAPOLB
SCHEMBL694149 0.77 MAOA (0.61) KDM4EALDH1A1LMNA
SCHEMBL22425030 0.77 GRIN2D (0.55) KDM4ECREBBPALDH1A1KMT2A
SCHEMBL244119 0.76 NOS1 (1.00) NOS1OGTPDE3BPDE3AKDM4E
SCHEMBL1519891 0.76 NOS1 (0.72) NOS1OGTPDE3BPDE3AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117756794-B Nitrogen-containing heterocyclic compound, and preparation method and application thereof 和径医药科技(上海)有限公司 2024-07-16 CN disclosed
CN-117756794-A Nitrogen-containing heterocyclic compound, and preparation method and application thereof 和径医药科技(上海)有限公司 2024-03-26 CN disclosed
US-11807635-B2 Nitrile derivative that acts as inhibitor of dipeptidyl peptidase 1 and use thereof HAISCO PHARMACEUTICALS PTE. LTD. (SG) 2023-11-07 US disclosed
US-20230121807-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF HAISCO PHARMACEUTICALS PTE. LTD (SG) 2023-04-20 US disclosed
WO-2022042591-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF 四川海思科制药有限公司 2022-03-03 WO disclosed
US-10226452-B2 Benzoxazolone derivatives as acid ceramidase inhibitors, and their use as medicaments THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-03-12 US disclosed
US-20170182010-A1 BENZOXAZOLONE DERIVATIVES AS ACID CERAMIDASE INHIBITORS, AND THEIR USE AS MEDICAMENTS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2017-06-29 US disclosed
US-8293775-B2 Benzoxazolone derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2012-10-23 US disclosed
EP-1432420-B1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARM INC (US) 2011-07-13 EP disclosed
US-7790726-B2 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2010-09-07 US disclosed
EP-0415641-B1 Substituted glutaramic acids and derivatives ROHM & HAAS (US) 1994-01-19 EP disclosed
US-5238908-A HERBICIDAL GLUTARAMIC ACIDS AND DERIVATIVES ROHM AND HAAS COMPANY (US) 1993-08-24 US disclosed
US-5232899-A Applying as pre- and post-emergence herbicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-03 US disclosed
EP-0415641-A1 Substituted glutaramic acids and derivatives ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed
EP-0415642-A1 Glutarimides ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed
EP-0170191-B1 TETRAHYDROPHTALIMIDES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-23 EP disclosed
US-4880925-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1989-11-14 US disclosed
US-4792605-A TETRAHYDROPHTHALIMIDES; HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1988-12-20 US disclosed
US-4640707-A Tetrahydrophthalimides and their herbicidal use SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1987-02-03 US disclosed
EP-0170191-A2 Tetrahydrophtalimides, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-02-05 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 (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-11807635-B2 Nitrile derivative that acts as inhibitor of dipeptidyl peptidase 1 and use thereof DPP4, DPP3, DPP9 NOS1 32/4885PPM1D 643/4885OGT 1298/4885
US-10226452-B2 Benzoxazolone derivatives as acid ceramidase inhibitors, and their use as medicaments ASAH1, ASAH2, ACER2 NOS1 3304/4885PPM1D 2851/4885OGT 2731/4885
US-20230121807-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF DPP4, DPP3, DPP9 NOS1 32/4885PPM1D 643/4885OGT 1298/4885
US-20170182010-A1 BENZOXAZOLONE DERIVATIVES AS ACID CERAMIDASE INHIBITORS, AND THEIR USE AS MEDICAMENTS ASAH1, ASAH2, ACER2 NOS1 3304/4885PPM1D 2851/4885OGT 2731/4885

“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.