SCHEMBL20214388

SCHEMBL20214388

CC(C)(C)OC(=O)N1CCC(Nc2ncc3cc(Br)ccc3n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.48
▸ KDM1A O60341 1/20 0.48
▸ EHMT2 Q96KQ7 1/20 0.48
▸ RCOR1 Q9UKL0 1/20 0.48
▸ USP30 Q70CQ3 2/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ DNMT3A Q9Y6K1 1/20 0.47
▸ NSD2 O96028 1/20 0.47
▸ CNR1 P21554 1/20 0.46
▸ BACE1 P56817 1/20 0.46
▸ PIK3CD O00329 1/20 0.45
▸ PIK3CA P42336 1/20 0.44
▸ CCNK O75909 4/20 0.44
▸ CCNA2 P20248 4/20 0.44
▸ CDK2 P24941 4/20 0.44

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
SCHEMBL31460754 1.00 ALDH1A1 (0.48) ALDH1A1KDM1AEHMT2RCOR1USP30
SCHEMBL889079 0.94 USP30 (0.53) USP30PIK3CDPIK3CACCNKCCNA2
SCHEMBL31460656 0.89 CCNK (0.49) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL28717093 0.89 CCNK (0.49) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL29494812 0.89 CCNK (0.49) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL29527460 0.89 CCNK (0.49) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL22787807 0.89 CCNK (0.49) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL23003081 0.86 USP30 (0.55) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL23003082 0.86 USP30 (0.55) USP30PIK3CDCCNKCCNA2CDK2
SCHEMBL31460649 0.85 ALDH1A1 (0.45) ALDH1A1KDM1AEHMT2RCOR1USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12528796-B2 Modulators of RAS GTPase TOSK, INC. (US) 2026-01-20 — — US disclosed
WO-2025076441-A1 COMPOUNDS OF GCN2 MODULATORS Alesta Therapeutics BV (NL) 2025-04-10 — — WO disclosed
US-20220227740-A1 Modulators of RAS GTPase TOSK, INC. 2022-07-21 — — US disclosed
US-10934275-B2 IRE1 small molecule inhibitors CORNELL UNIVERSITY (US) 2021-03-02 — — US disclosed
WO-2020214537-A1 MODULATORS OF RAS GTPASE TOSK, INC. (US) 2020-10-22 — — WO disclosed
EP-3548476-A1 IRE1 SMALL MOLECULE INHIBITORS Quentis Therapeutics, Inc. (US) 2019-10-09 — — EP disclosed
US-20190276434-A1 IRE1 Small Molecule Inhibitors QUENTIS THERAPEUTICS, INC. (US) 2019-09-12 — — US disclosed
WO-2018102751-A1 IRE1 SMALL MOLECULE INHIBITORS QUENTIS THERAPEUTICS, INC. (US) 2018-06-07 — — WO disclosed
WO-2018102751-A1 IRE1 SMALL MOLECULE INHIBITORS QUENTIS THERAPEUTICS, INC. (US) 2018-06-07 — — 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 (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-10934275-B2 IRE1 small molecule inhibitors XBP1, ERN2, ERN1 ALDH1A1 3482/4885KDM1A 2007/4885EHMT2 3194/4885
US-20220227740-A1 Modulators of RAS GTPase KRAS, HRAS, NRAS ALDH1A1 4302/4885KDM1A 4435/4885EHMT2 3083/4885
US-20190276434-A1 IRE1 Small Molecule Inhibitors XBP1, ERN2, ERN1 ALDH1A1 3482/4885KDM1A 2007/4885EHMT2 3194/4885
US-12528796-B2 Modulators of RAS GTPase KRAS, NRAS, HRAS ALDH1A1 4254/4885KDM1A 4553/4885EHMT2 3267/4885

“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.

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