SCHEMBL60814

SCHEMBL60814

[CH]1CCN(Cc2ccccc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.74
MC4R P32245 1/20 0.61
DRD4 P21917 1/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 1/20 0.59
ACHE P22303 2/20 0.57
CCR3 P51677 2/20 0.55
CYP3A4 P08684 1/20 0.55
HSD17B10 Q99714 1/20 0.55
BCHE P06276 1/20 0.55
BACE1 P56817 1/20 0.55
KDM4E B2RXH2 1/20 0.55

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
SCHEMBL6989203 0.92 SIGMAR1 (0.63) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL159371 0.87 SIGMAR1 (0.61) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL12535945 0.86 SIGMAR1 (0.74) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL576868 0.85 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL242970 0.85 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL8188324 0.85 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL2489199 0.85 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1041303 0.85 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1415730 0.85 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
Water SCHEMBL8695926 0.83 SIGMAR1 (0.95) SIGMAR1MC4RDRD4LMNAPOLB

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 1409 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117843569-A Isoquinoline acrylamide CDK8 inhibitor, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2024-04-09 CN claimed
US-20230348453-A1 HALOGENATED-HETEROARYL AND OTHER HETEROCYCLIC KINASE INHIBITORS, AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2023-11-02 US claimed
US-20230339904-A1 ISOINDOLINONES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. 2023-10-26 US claimed
US-20230265103-A1 NOVEL INHIBITORS OF PIKFYVE AND METHODS USING SAME TME THERAPEUTICS LLC 2023-08-24 US claimed
WO-2023146785-A1 PYRROLIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2023-08-03 WO claimed
EP-4139305-A1 HALOGENATED-HETEROARYL AND OTHER HETEROCYCLIC KINASE INHIBITORS, AND USES THEREOF iOmx Therapeutics AG (DE) 2023-03-01 EP claimed
CN-115667255-A Halogenated heteroaryl and other heterocyclic kinase inhibitors and uses thereof 艾欧麦克斯治疗股份公司 2023-01-31 CN claimed
EP-3256464-B1 COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARM SPA (IT) 2022-05-11 EP claimed
CN-109923108-B Pyridyl-substituted indole compounds 百时美施贵宝公司 2022-04-29 CN claimed
US-20210393614-A1 QUINONE REDUCTASE 2 INHIBITORS FOR USE AS NEUROPROTECTIVE AGENTS UNIV DUKE (US) 2021-12-23 US claimed
US-5130303-A Pyridine derivative administering NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-07-14 US claimed
WO-1992011232-A1 CHELATING AGENTS NYCOMED IMAGING AS (NO) 1992-07-09 WO claimed
EP-0426180-A2 Imidazo[4,5-b] quinolinyloxyalkanoic acid amides with enhanced water solubility Bristol-Myers Squibb Company (US) 1991-05-08 EP claimed
US-4943573-A ENZYME INHIBITORS, CARDIOTONIC, ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 1990-07-24 US claimed
EP-0374808-A2 Xanthin derivatives having an adenosin-antagonist activity BOEHRINGER INGELHEIM KG (DE) 1990-06-27 EP claimed
EP-0353692-A2 Drug effect-enhancing agent for antitumor drug NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-02-07 EP claimed
US-4886806-A ANTIINFLAMMATORY AGENTS KALI-CHEMIE PHARMA GMBH (DE) 1989-12-12 US claimed
EP-0207674-A2 1,4-Dihydropyridine derivatives, their preparation and their pharmaceutical use SANKYO COMPANY LIMITED (JP) 1987-01-07 EP claimed
EP-0186977-A2 Renin-inhibitory dipeptides, their preparation and use SANKYO COMPANY LIMITED (JP) 1986-07-09 EP claimed
EP-0079740-B1 ANTHRANILOYLOXYALKANOATES RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1985-11-13 EP claimed

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-20230339904-A1 ISOINDOLINONES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS CSNK1A1, CSNK1D, CSNK1G1 SIGMAR1 2968/4885MC4R 3625/4885DRD4 3477/4885
US-20230265103-A1 NOVEL INHIBITORS OF PIKFYVE AND METHODS USING SAME PIKFYVE, PIK3CD, PIK3R5 SIGMAR1 4725/4885MC4R 1754/4885DRD4 2590/4885
US-20230348453-A1 HALOGENATED-HETEROARYL AND OTHER HETEROCYCLIC KINASE INHIBITORS, AND USES THEREOF ABL1, PRKDC, PRKACA SIGMAR1 3814/4885MC4R 2468/4885DRD4 4803/4885
US-20210393614-A1 QUINONE REDUCTASE 2 INHIBITORS FOR USE AS NEUROPROTECTIVE AGENTS NQO1, TXNRD2, NQO2 SIGMAR1 3840/4885MC4R 4519/4885DRD4 3315/4885

“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.