SCHEMBL4294963

SCHEMBL4294963

CCN1CCN(CCCCl)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
KDM1A O60341 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
GNAI3 P08754 1/20 0.39
GNAO1 P09471 1/20 0.39
GNAI1 P63096 1/20 0.39
TLR9 Q9NR96 1/20 0.38
TLR7 Q9NYK1 1/20 0.38

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
Hydrochloric Acid SCHEMBL28170249 0.98 MAPK1 (0.42) MAPK1RAB9AKDM1ASIGMAR1GNAI3
SCHEMBL23853043 0.87 HRH3 (0.43) SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL3412350 0.87
SCHEMBL3450930 0.85 GNAI3 (0.43) SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL3441890 0.84 SIGMAR1 (0.41) MAPK1RAB9AKDM1ASIGMAR1
SCHEMBL6659406 0.84 KDM1A (0.48) MAPK1RAB9AKDM1AGNAI3GNAO1
SCHEMBL6663102 0.84 GNAI3 (0.50) MAPK1RAB9AKDM1AGNAI3GNAO1
SCHEMBL9644931 0.83 GNAI3 (0.57) SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL167231 0.82 PAOX (0.47) RAB9ASIGMAR1
SCHEMBL6659172 0.81 GNAI3 (0.54) GNAI3GNAO1GNAI1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11168084-B2 Purine based compounds as toll-like receptor 9 antagonist COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-11-09 US claimed
EP-3707140-B1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONISTS COUNCIL SCIENT IND RES (IN) 2021-10-13 EP claimed
US-20200347062-A1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONIST COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-11-05 US claimed
EP-3707140-A1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONIST Council of Scientific and Industrial Research (IN) 2020-09-16 EP claimed
CN-118339169-A Amine-containing vinyldisiloxane in elastomeric polymer manufacture 盛禧奥欧洲有限责任公司 2024-07-12 CN disclosed
CN-115141153-B Benzodiazepine compound and preparation method and application thereof 徐州医科大学 2023-11-14 CN disclosed
WO-2023099462-A1 AMINE-CONTAINING VINYLDISILOXANES IN THE MANUFACTURE OF ELASTOMERIC POLYMERS TRINSEO EUROPE GMBH (CH) 2023-06-08 WO disclosed
EP-4186911-A1 AMINE-CONTAINING VINYLDISILOXANES IN THE MANUFACTURE OF ELASTOMERIC POLYMERS Trinseo Europe GmbH (CH) 2023-05-31 EP disclosed
CN-115141153-A Benzodiazepine compound and preparation method and application thereof 徐州医科大学 2022-10-04 CN disclosed
US-11168084-B2 Purine based compounds as toll-like receptor 9 antagonist COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-11-09 US disclosed
US-11168084-B2 Purine based compounds as toll-like receptor 9 antagonist COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-11-09 US disclosed
EP-3707140-B1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONISTS COUNCIL SCIENT IND RES (IN) 2021-10-13 EP disclosed
EP-3707140-B1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONISTS COUNCIL SCIENT IND RES (IN) 2021-10-13 EP disclosed
US-20200347062-A1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONIST COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-11-05 US disclosed
US-20200347062-A1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONIST COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-11-05 US disclosed
EP-3707140-A1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONIST Council of Scientific and Industrial Research (IN) 2020-09-16 EP disclosed
US-8318769-B2 Substituted sulfonamide compounds GRUENETHAL GMBH (DE) 2012-11-27 US disclosed
US-20090264400-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
US-4272538-A 5-Nitro-imidazole with antiprotozoic activity ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1981-06-09 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 (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-11168084-B2 Purine based compounds as toll-like receptor 9 antagonist TLR9, TLR1, TLR7 MAPK1 109/4885RAB9A 1421/4885KDM1A 1309/4885
US-20200347062-A1 PURINE BASED COMPOUNDS AS TOLL-LIKE RECEPTOR 9 ANTAGONIST TLR9, TLR1, TLR7 MAPK1 128/4885RAB9A 1412/4885KDM1A 1392/4885
US-20090264400-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, TRPV1 MAPK1 419/4885RAB9A 3451/4885KDM1A 2286/4885

“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.