SCHEMBL7427751

SCHEMBL7427751

CC(C)(C)OCC1CCCN1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.45
CHRNA4 P43681 1/20 0.45
CHRNB4 P30926 5/20 0.44
CHRNA3 P32297 5/20 0.44
LTA4H P09960 3/20 0.41
CHRNA5 P30532 1/20 0.41
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL7427755 1.00 CHRNB2 (0.45) CHRNB2CHRNA4CHRNB4CHRNA3LTA4H
SCHEMBL12083445 1.00 CHRNB2 (0.45) CHRNB2CHRNA4CHRNB4CHRNA3LTA4H
SCHEMBL7425051 0.94 LTA4H (0.43) CHRNB2CHRNA4LTA4HALDH1A1
SCHEMBL7420348 0.94 LTA4H (0.43) CHRNB2CHRNA4LTA4HALDH1A1
SCHEMBL7420352 0.94 LTA4H (0.43) CHRNB2CHRNA4LTA4HALDH1A1
SCHEMBL21743272 0.84 CHRNB2 (0.43) CHRNB2CHRNA4CHRNB4CHRNA3LTA4H
SCHEMBL18568746 0.81 CHRNB2 (0.41) CHRNB2CHRNA4CHRNB4CHRNA3LTA4H
SCHEMBL12403589 0.80 CHRNB2 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA5
SCHEMBL3332629 0.79 LTA4H (0.42) CHRNB2CHRNA4CHRNB4CHRNA3LTA4H
SCHEMBL19557797 0.78 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB4CHRNA3LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2023-11-16 US disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
EP-4105203-A1 SPIRO-CONDENSED INDOLE COMPOUNDS AS EHMT2 INHIBITORS Epizyme Inc (US) 2022-12-21 EP disclosed
US-11236068-B2 Fused ring compounds GENENTECH, INC. (US) 2022-02-01 US disclosed
US-20210230142-A9 FUSED RING COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2021-07-29 US disclosed
US-20210213014-A1 METHODS OF USING EHMT2 INHIBITORS IN IMMUNOTHERAPIES Epizyme, Inc. 2021-07-15 US disclosed
CN-107667097-B Separation of enantiomers of 3-ethylbicyclo [3.2.0] hept-3-en-6-one 诺瓦色生物公司 2021-02-12 CN disclosed
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF Epizyme, Inc. 2020-10-08 US disclosed
US-20200181118-A1 FUSED RING COMPOUNDS GENENTECH INC (US) 2020-06-11 US disclosed
US-20200113901-A1 METHODS OF USING EHMT2 INHIBITORS Epizyme, Inc. 2020-04-16 US disclosed
US-9035103-B2 Optical resolution methods for bicyclic compounds using asymmetric catalysts DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-05-19 US disclosed
US-20150087630-A1 METHODS OF USE OF DIAZACARBAZOLES FOR TREATING CANCER GENENTECH, INC. (US) 2015-03-26 US disclosed
EP-2792664-A1 OPTICAL RESOLUTION METHOD FOR BICYCLIC COMPOUND USING ASYMMETRIC CATALYST DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-10-22 EP disclosed
US-20140296569-A1 Optical Resolution Method for Bicyclic Compound Using Asymmetric Catalyst DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-10-02 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
US-20110183938-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2011-07-28 US disclosed
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
EP-0815103-A1 TRYPSIN AND THROMBIN INHIBITORS Novartis AG (CH) 1998-01-07 EP disclosed
WO-1996029327-A1 TRYPSIN AND THROMBIN INHIBITORS NOVARTIS AG (CH) 1996-09-26 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 (12 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-20210230142-A9 FUSED RING COMPOUNDS KRAS, NRAS, HRAS CHRNB2 3939/4885CHRNA4 4710/4885CHRNB4 4283/4885
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 CHRNB2 2833/4885CHRNA4 4286/4885CHRNB4 3911/4885
US-20140296569-A1 Optical Resolution Method for Bicyclic Compound Using Asymmetric Catalyst OXER1, OCIAD2, AOC2 CHRNB2 2940/4885CHRNA4 2460/4885CHRNB4 2928/4885
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF HNMT, EHMT2, SHMT2 CHRNB2 1153/4885CHRNA4 2709/4885CHRNB4 2582/4885
US-20110183938-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B CHRNB2 3164/4885CHRNA4 3868/4885CHRNB4 3360/4885
US-20150087630-A1 METHODS OF USE OF DIAZACARBAZOLES FOR TREATING CANCER IDH3B, IDH3A, EGLN3 CHRNB2 1905/4885CHRNA4 2044/4885CHRNB4 1873/4885
US-20140171407-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B CHRNB2 3164/4885CHRNA4 3868/4885CHRNB4 3360/4885
US-20200113901-A1 METHODS OF USING EHMT2 INHIBITORS EHMT2, EHMT1, BHMT CHRNB2 546/4885CHRNA4 1620/4885CHRNB4 1105/4885
US-11672800-B2 Combination therapies with EHMT2 inhibitors EHMT2, BHMT, SHMT2 CHRNB2 2833/4885CHRNA4 4286/4885CHRNB4 3911/4885
US-20200181118-A1 FUSED RING COMPOUNDS KRAS, NRAS, HRAS CHRNB2 3939/4885CHRNA4 4710/4885CHRNB4 4283/4885
US-11236068-B2 Fused ring compounds KRAS, NRAS, HRAS CHRNB2 3939/4885CHRNA4 4710/4885CHRNB4 4283/4885
US-20210213014-A1 METHODS OF USING EHMT2 INHIBITORS IN IMMUNOTHERAPIES EHMT2, BHMT2, BHMT CHRNB2 1911/4885CHRNA4 3776/4885CHRNB4 3492/4885

“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.