SCHEMBL2157702

SCHEMBL2157702

C1CC(NC2COC2)CCN1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.39
GNAI3 P08754 3/20 0.37
GNAO1 P09471 3/20 0.37
GNAI1 P63096 3/20 0.37
KDM1A O60341 11/20 0.36
MAOB P27338 4/20 0.36
CISD1 Q9NZ45 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR1B P28222 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
POLB P06746 1/20 0.35
MAOA P21397 3/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KCNH2 Q12809 1/20 0.32

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
SCHEMBL21425603 0.86 KCNH2 (0.43) EPHX1KDM1AMAOBSLC6A2SLC6A4
SCHEMBL28363633 0.84 EPHX1 (0.35) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL28363635 0.84 EPHX1 (0.35) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL34470892 0.84 EPHX1 (0.35) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL3237330 0.84 EPHX1 (0.50) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL2693563 0.81
SCHEMBL1955385 0.81 EPHX1 (0.48) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL20500000 0.81 EPHX1 (0.37) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL20500003 0.81 EPHX1 (0.37) EPHX1GNAI3GNAO1GNAI1KDM1A
SCHEMBL4239836 0.80 EPHX1 (0.39) EPHX1GNAI3GNAO1GNAI1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114761404-B Substituted bicyclic heteroaryl compounds 百时美施贵宝公司 2025-02-21 CN claimed
WO-2026087909-A1 COMPOUNDS FOR USE AS NEUROPROTECTIVE AGENTS AND/OR IN INHIBITING FORMATION OF ALPHA-SYNUCLEIN AGGREGATES AC IMMUNE SA (CH) 2026-04-30 WO disclosed
EP-4713093-A1 NOVEL COMPOUNDS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH ALPHA-SYNUCLEIN AGGREGATES AC Immune SA (CH) 2026-03-25 EP disclosed
CN-114761404-B Substituted bicyclic heteroaryl compounds 百时美施贵宝公司 2025-02-21 CN disclosed
WO-2024236059-A1 NOVEL COMPOUNDS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH ALPHA-SYNUCLEIN AGGREGATES AC IMMUNE SA (CH) 2024-11-21 WO disclosed
CN-111699185-B 6-azaindole compounds 百时美施贵宝公司 2023-06-27 CN disclosed
EP-4041730-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS Bristol-Myers Squibb Company (US) 2022-08-17 EP disclosed
EP-2513110-B1 1,7-DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER HOFFMANN LA ROCHE (CH) 2018-12-05 EP disclosed
US-9440976-B2 1,7-diazacarbazoles and methods of use GENENTECH, INC. (US) 2016-09-13 US disclosed
US-20150328195-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2015-11-19 US disclosed
US-20140171407-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2014-06-19 US disclosed
US-20110183938-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2011-07-28 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-20150328195-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B EPHX1 1663/4885GNAI3 968/4885GNAO1 2325/4885
US-20110183938-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B EPHX1 1663/4885GNAI3 968/4885GNAO1 2325/4885
US-20140171407-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B EPHX1 1663/4885GNAI3 968/4885GNAO1 2325/4885

“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.