SCHEMBL106639

SCHEMBL106639

Nc1ccc(N2CCOCC2)nn1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ CNR2 P34972 10/20 0.50
▸ KDM4E B2RXH2 4/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ PKM P14618 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CRHBP P24387 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45

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
SCHEMBL31047535 1.00 MEN1 (0.54) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL5754979 0.88 ALDH1A1 (0.61) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL18291244 0.84 MAP4K4 (0.47) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL4020520 0.82 CYP1A2 (0.57) NPC1RAB9AALDH1A1SMN1; SMN2HTT
SCHEMBL4020924 0.80 CYP1A2 (0.60) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL2866512 0.78 CYP1A2 (0.40) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL13279548 0.78 MAP4K4 (0.57) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL14051230 0.77 CNR2 (0.70) MEN1NPC1RAB9AKMT2ACNR2
SCHEMBL611989 0.77 HRH4 (0.51) KMT2AALDH1A1KDM4EMAPTCYP1A2
SCHEMBL3723054 0.77 BPTF (0.62) ALDH1A1HTTKDM4EHSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106008533-A Cdk inhibitors G1治疗公司 2016-10-12 — — CN claimed
US-12600726-B2 Antagonists of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2026-04-14 — — US disclosed
US-12472181-B2 Compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders GALAPAGOS NV (BE) 2025-11-18 — — US disclosed
US-12421211-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2025-09-23 — — US disclosed
US-20240368117-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-11-07 — — US disclosed
US-20240325404-A1 TREATMENT OF INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2024-10-03 — — US disclosed
EP-4370128-A1 TREATMENT OF INFLAMMATORY DISEASES Galapagos N.V. (BE) 2024-05-22 — — EP disclosed
EP-3532474-B1 4,5-ANNULATED 1,2,4-TRIAZOLONES BAYER AG (DE) 2024-03-27 — — EP disclosed
CN-117677387-A Treatment of inflammatory diseases 加拉帕戈斯股份有限公司 2024-03-08 — — CN disclosed
CN-117534670-A Novel compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders 加拉帕戈斯股份有限公司 2024-02-09 — — CN disclosed
WO-2012142329-A1 COMPOSITIONS AND THERAPEUTIC USES OF IKK-RELATED KINASE EPSILON AND TANKBINDING KINASE 1 INHIBITORS MYREXIS, INC. (US) 2012-10-18 — — WO disclosed
US-20120128630-A1 1-(6 MEMBERS AZO-HETEROCYCLIC)-PYRROLIN-2-ONE COMPOUNDS AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARAMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE VIVALIS (FR) 2012-05-24 — — US disclosed
EP-2451800-A1 1-(6 MEMBERS AZO-HETEROCYCLIC)-PYRROLIN-2-ONE COMPOUNDS AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE Vivalis (FR) 2012-05-16 — — EP disclosed
EP-2426109-A1 NOVEL KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2012-03-07 — — EP disclosed
US-7943618-B2 Btk protein kinase inhibitors ROCHE PALO ALTO LLC (US) 2011-05-17 — — US disclosed
WO-2011004017-A1 1-(6 MEMBERS AZO-HETEROCYCLIC)-PYRROLIN-2-ONE COMPOUNDS AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE VIVALIS (FR) 2011-01-13 — — WO disclosed
EP-2205564-A1 NOVEL KINASE INHIBITORS F. Hoffmann-Roche AG (CH) 2010-07-14 — — EP disclosed
WO-2009053269-A1 NOVEL KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-30 — — WO disclosed
US-20090105209-A1 BTK protein kinase inhibitors ROCHE PALO ALTO LLC 2009-04-23 — — US disclosed
US-4104385-A Cyclic alkylidenyl N-[6-(amino)-3-pyridazinyl]aminomethylenemalonates STERLING DRUG INC. (US) 1978-08-01 — — 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 (7 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-20240325404-A1 TREATMENT OF INFLAMMATORY DISEASES IFNAR1, IFNG, IRF3 MEN1 1365/4885NPC1 190/4885RAB9A 1049/4885
US-12421211-B2 Heterocyclic compounds F12, C1R, MRPL21 MEN1 244/4885NPC1 1233/4885RAB9A 550/4885
US-20120128630-A1 1-(6 MEMBERS AZO-HETEROCYCLIC)-PYRROLIN-2-ONE COMPOUNDS AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARAMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE NAT1, POLM, PYGL MEN1 4116/4885NPC1 640/4885RAB9A 2946/4885
US-20090105209-A1 BTK protein kinase inhibitors BTK, SYK, LYN MEN1 4351/4885NPC1 4365/4885RAB9A 1663/4885
US-20240368117-A1 HETEROCYCLIC COMPOUNDS F12, C1R, MRPL21 MEN1 244/4885NPC1 1233/4885RAB9A 550/4885
US-12600726-B2 Antagonists of the muscarinic acetylcholine receptor M4 CHRM3, CHRM4, CHRM2 MEN1 2196/4885NPC1 503/4885RAB9A 2745/4885
US-12472181-B2 Compounds and pharmaceutical compositions thereof for the treatment of inflammatory disorders IL15, IL2, IL33 MEN1 1551/4885NPC1 1352/4885RAB9A 3173/4885

“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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