SCHEMBL282999

SCHEMBL282999

COc1cc(N)ccc1C1CCN(C)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
QDPR P09417 1/20 0.52
HTR1D P28221 3/20 0.52
HTR1B P28222 3/20 0.52
DRD2 P14416 1/20 0.44
APP P05067 1/20 0.43
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
NR4A1 P22736 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
EHMT2 Q96KQ7 1/20 0.40
HTR1F P30939 2/20 0.40
HTR2A P28223 1/20 0.39
ADRA2C P18825 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
SCHEMBL30496473 1.00 QDPR (0.52) QDPRHTR1DHTR1BDRD2APP
SCHEMBL10036163 0.92 HTR1D (0.49) QDPRHTR1DHTR1BDRD2APP
SCHEMBL7029357 0.88 QDPR (0.52) QDPRHTR1DHTR1BDRD2APP
SCHEMBL2570589 0.87 MAPT (0.48) GAAMAPTTSHRMAPK1HTT
SCHEMBL4562943 0.84 HTR1D (0.49) QDPRHTR1DHTR1BDRD2GAA
SCHEMBL30020108 0.84 HTR1D (0.49) QDPRHTR1DHTR1BDRD2MAPT
SCHEMBL20899571 0.84 MEN1 (0.39) QDPRHTR1DHTR1BDRD2GAA
SCHEMBL30962643 0.84 HTR1D (0.49) QDPRHTR1DHTR1BDRD2GAA
SCHEMBL30868519 0.83 HTR2A (0.54) GAAMAPTTSHRMAPK1HTT
SCHEMBL10036181 0.83 DRD2 (0.51) DRD2MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260078126-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2026-03-19 US disclosed
EP-4642767-A1 PYRIMIDINE CARBOXAMIDE COMPOUNDS Acrivon Therapeutics, Inc. (US) 2025-11-05 EP disclosed
US-12448364-B2 2, 4-diaminopyrimidine derivative and application thereof SHANGHAI ZHEYE BIOTECHNOLOGY CO., LTD. (CN) 2025-10-21 US disclosed
US-12398145-B2 Bicyclic urea kinase inhibitors and uses thereof THE BROAD INSTITUTE, INC. (US) 2025-08-26 US disclosed
US-12121521-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis THE GENERAL HOSPITAL CORPORATION (US) 2024-10-22 US disclosed
US-20240245695-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS THE GENERAL HOSPITAL CORPORATION (US) 2024-07-25 US disclosed
US-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2024-07-11 US disclosed
WO-2024145505-A1 PYRIMIDINE CARBOXAMIDE COMPOUNDS ACRIVON THERAPEUTICS, INC. (US) 2024-07-04 WO disclosed
US-11878019-B2 Uses of pyrimidopyrimidinones as SIK inhibitors THE GENERAL HOSPITAL CORPORATION (US) 2024-01-23 US disclosed
US-11725011-B2 Bicyclic urea kinase inhibitors and uses thereof THE GENERAL HOSPITAL CORPORATION (US) 2023-08-15 US disclosed
US-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2014-12-18 US disclosed
US-20140142084-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2014-05-22 US disclosed
US-8471005-B2 Pyrrolotriazines as ALK and JAK2 inhibitors CEPHALON, INC. (US) 2013-06-25 US disclosed
WO-2012053606-A1 ARYLAMINOHETEROCYCLIC CARBOXAMIDE COMPOUND アステラス製薬株式会社 (JP) 2012-04-26 WO disclosed
EP-2428508-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND Astellas Pharma Inc. (JP) 2012-03-14 EP disclosed
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND WATERS TECHNOLOGIES CORPORATION (US) 2012-02-16 US disclosed
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND WATERS TECHNOLOGIES CORPORATION (US) 2012-02-16 US disclosed
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 US disclosed
EP-2376491-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS Cephalon, Inc. (US) 2011-10-19 EP disclosed
WO-2010071885-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2010-06-24 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-12121521-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis SOST, CSF1R, SIK2 QDPR 4306/4885HTR1D 4439/4885HTR1B 4466/4885
US-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 QDPR 986/4885HTR1D 3635/4885HTR1B 3677/4885
US-20260078126-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF SIK2, SBK3, SIK3 QDPR 4510/4885HTR1D 3757/4885HTR1B 1857/4885
US-20140142084-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND FGFR3, FGFR1, FGFR2 QDPR 1818/4885HTR1D 1845/4885HTR1B 1829/4885
US-12398145-B2 Bicyclic urea kinase inhibitors and uses thereof SIK1, SIK2, SIK3 QDPR 4720/4885HTR1D 3345/4885HTR1B 3230/4885
US-12448364-B2 2, 4-diaminopyrimidine derivative and application thereof ALK, DPYD, ABL2 QDPR 112/4885HTR1D 2211/4885HTR1B 2008/4885
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 QDPR 986/4885HTR1D 3635/4885HTR1B 3677/4885
US-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF WEE1, WEE2, DCLRE1B QDPR 3742/4885HTR1D 4471/4885HTR1B 4632/4885
US-11878019-B2 Uses of pyrimidopyrimidinones as SIK inhibitors SIK2, SIK1, SIK3 QDPR 1550/4885HTR1D 4577/4885HTR1B 4297/4885
US-20240245695-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS SIK2, SIK1, SIK3 QDPR 1550/4885HTR1D 4577/4885HTR1B 4297/4885
US-11725011-B2 Bicyclic urea kinase inhibitors and uses thereof SIK1, SIK2, SIK3 QDPR 4720/4885HTR1D 3345/4885HTR1B 3230/4885
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS JAK2, ALK, ABL1 QDPR 807/4885HTR1D 3024/4885HTR1B 2523/4885

“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.