SCHEMBL1587086

SCHEMBL1587086

N=C(N)c1ccc(CO)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 7/20 1.00
▸ PRSS3 P35030 5/20 1.00
▸ PRSS2 P07478 4/20 1.00
▸ F10 P00742 2/20 0.67
▸ LOXL2 Q9Y4K0 1/20 0.67
▸ F2 P00734 7/20 0.55
▸ ST14 Q9Y5Y6 2/20 0.55
▸ TMPRSS6 Q8IU80 1/20 0.55
▸ PLAU P00749 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ MASP2 O00187 1/20 0.54
▸ THPO P40225 1/20 0.54
▸ PLG P00747 2/20 0.53
▸ C1S P09871 1/20 0.53
▸ APEX1 P27695 1/20 0.52
▸ PLAT P00750 1/20 0.51
▸ KLKB1 P03952 1/20 0.51
▸ F12 P00748 1/20 0.50
▸ F7 P08709 1/20 0.50
▸ F3 P13726 1/20 0.50

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
SCHEMBL2717268 0.82 PRSS1 (0.70) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL20610488 0.81 PRSS1 (0.68) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL537030 0.81 LMNA (0.77) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL2800579 0.80 PRSS1 (0.67) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL49594 0.80 LOXL2 (1.00) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL1696572 0.78 PRSS1 (0.64) PRSS1PRSS3PRSS2F10LOXL2
Hydrochloric Acid SCHEMBL322008 0.78 LOXL2 (0.95) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL1587085 0.78 PRSS1 (0.64) PRSS1PRSS3PRSS2F10LOXL2
Hydrochloric Acid SCHEMBL1981173 0.78 LOXL2 (0.95) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL6484071 0.78 PRSS1 (0.64) PRSS1PRSS3PRSS2F10LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117279664-A FOLR1 binding agents, conjugates thereof, and methods of use thereof 普方生物制药美国公司 2023-12-22 — — CN disclosed
EP-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 — — EP disclosed
US-20230159441-A1 ENZYME-CLEAVABLE METHADONE PRODRUGS AND METHODS OF USE THEREOF 3I, LP 2023-05-25 — — US disclosed
US-11573224-B2 Methods of detection using X-ray fluorescence ICAGEN, LLC (US) 2023-02-07 — — US disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 — — US disclosed
US-20220175699-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE AMPHETAMINE PRODRUGS AND INHIBITORS THEREOF 3I, LP 2022-06-09 — — US disclosed
US-11179355-B2 Compositions comprising enzyme-cleavable amphetamine prodrugs and inhibitors thereof SIGNATURE THERAPEUTICS, INC. (US) 2021-11-23 — — US disclosed
US-11154549-B2 Opioid compositions resistant to overdose and abuse ELYSIUM THERAPEUTICS, INC. (US) 2021-10-26 — — US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 — — US disclosed
EP-2683394-B1 ACTIVE AGENT PRODRUGS WITH HETEROCYCLIC LINKERS SIGNATURE THERAPEUTICS INC (US) 2021-01-06 — — EP disclosed
US-20100331545-A1 REGULATOR FOR SIGNALING TOLL-LIKE RECEPTOR, WHICH COMPRISES CATHEPSIN INHIBITOR AS ACTIVE INGREDIENT NIPPON CHEMIPHAR CO., LTD. (JP) 2010-12-30 — — US disclosed
EP-2216047-A1 REGULATOR FOR SIGNALING OF TOLL-LIKE RECEPTOR, WHICH COMPRISES CATHEPSIN INHIBITOR AS ACTIVE INGREDIENT National University Corporation Tokyo Medical and Dental University (JP) 2010-08-11 — — EP disclosed
EP-2168600-A1 THERAPEUTIC OR PROPHYLACTIC AGENT FOR CEREBRAL ANEURYSM Nippon Chemiphar Co., Ltd. (JP) 2010-03-31 — — EP disclosed
US-20080220441-A1 Advanced drug development and manufacturing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-09-11 — — US disclosed
US-6689785-B2 USEFUL PARTICULARLY AS REMEDIES FOR BONE DISEASES AND ARTHRITIS NIPPON CHEMIPHAR CO., LTD. (JP) 2004-02-10 — — US disclosed
EP-1342720-A2 Epoxysuccinamide derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 2003-09-10 — — EP disclosed
EP-1022276-B1 EPOXYSUCCINAMIDE DERIVATIVES NIPPON CHEMIPHAR CO (JP) 2003-05-28 — — EP disclosed
US-6387908-B1 BONE DISORDERS; ANTIARTHRITIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 2002-05-14 — — US disclosed
EP-1022276-A1 EPOXYSUCCINAMIDE DERIVATIVES NIPPON CHEMIPHAR CO., LTD. (JP) 2000-07-26 — — EP disclosed
EP-0832076-A1 NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-04-01 — — 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 (5 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-11179355-B2 Compositions comprising enzyme-cleavable amphetamine prodrugs and inhibitors thereof ACHE, COMT, CES2 PRSS1 96/4885PRSS3 150/4885PRSS2 131/4885
US-20230159441-A1 ENZYME-CLEAVABLE METHADONE PRODRUGS AND METHODS OF USE THEREOF CES2, ACHE, COMT PRSS1 63/4885PRSS3 61/4885PRSS2 55/4885
US-20100331545-A1 REGULATOR FOR SIGNALING TOLL-LIKE RECEPTOR, WHICH COMPRISES CATHEPSIN INHIBITOR AS ACTIVE INGREDIENT TLR1, TLR7, TLR6 PRSS1 463/4885PRSS3 623/4885PRSS2 482/4885
US-20220175699-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE AMPHETAMINE PRODRUGS AND INHIBITORS THEREOF ACHE, DNPEP, ACE PRSS1 35/4885PRSS3 34/4885PRSS2 37/4885
US-11154549-B2 Opioid compositions resistant to overdose and abuse OPRM1, OPRK1, OPRD1 PRSS1 952/4885PRSS3 646/4885PRSS2 665/4885

“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.

Send feedback