SCHEMBL7595350

SCHEMBL7595350

NCCCN1CCC(N2CCCCC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.50
L3MBTL3 Q96JM7 4/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
KEAP1 Q14145 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM1A O60341 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42

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 SCHEMBL2516674 0.98 HRH3 (0.49) HRH3L3MBTL3L3MBTL1KEAP1SMN1; SMN2
SCHEMBL19495063 0.94 HRH3 (0.49) HRH3L3MBTL3L3MBTL1KDM1ACYP3A4
SCHEMBL1309460 0.88 ALOX15 (0.48) HRH3L3MBTL3L3MBTL1KDM1A
SCHEMBL1309249 0.86 ALOX15 (0.50) HRH3L3MBTL3L3MBTL1KDM1A
SCHEMBL7471957 0.85 SIGMAR1 (0.51)
SCHEMBL3979601 0.82 SIGMAR1 (0.49) KEAP1SMN1; SMN2
SCHEMBL7513389 0.82 KEAP1 (0.48) KEAP1SMN1; SMN2KDM1A
SCHEMBL24326956 0.81 HRH3 (0.50) HRH3L3MBTL3L3MBTL1SMN1; SMN2KDM1A
SCHEMBL24218139 0.79 GNAO1 (0.53) HRH3L3MBTL3L3MBTL1SMN1; SMN2
SCHEMBL13091289 0.79 KEAP1 (0.42) HRH3KEAP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3131890-B1 COMPOUNDS FOR TREATING VIRAL INFECTIONS PASTEUR INSTITUT KOREA (KR) 2019-04-24 EP disclosed
EP-3131890-B1 COMPOUNDS FOR TREATING VIRAL INFECTIONS PASTEUR INSTITUT KOREA (KR) 2019-04-24 EP disclosed
US-9809602-B2 Compounds for treating viral infections INSTITUT PASTEUR KOREA (KR) 2017-11-07 US disclosed
US-9809602-B2 Compounds for treating viral infections INSTITUT PASTEUR KOREA (KR) 2017-11-07 US disclosed
US-9809602-B2 Compounds for treating viral infections INSTITUT PASTEUR KOREA (KR) 2017-11-07 US disclosed
EP-2188299-B1 COMPOUNDS FOR TREATING DIABETES OHR PHARMACEUTICAL INC (US) 2017-10-25 EP disclosed
EP-3131890-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS Institut Pasteur Korea (KR) 2017-02-22 EP disclosed
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2017-02-16 US disclosed
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2017-02-16 US disclosed
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2017-02-16 US disclosed
WO-2015158908-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2015-10-22 WO disclosed
WO-2015158908-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2015-10-22 WO disclosed
WO-2007117180-A1 AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) 2007-10-18 WO disclosed
WO-2002099388-A2 BENZODIAZEPINE BRADYKININ ANTAGONISTS MERCK & CO., INC. (US) 2002-12-12 WO 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 (1 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-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, EIF2AK2 HRH3 2108/4885L3MBTL3 842/4885L3MBTL1 992/4885

“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.