SCHEMBL19198550

SCHEMBL19198550

COc1ccc(CNc2cccnc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.69
PDE4B Q07343 3/20 0.60
DYRK1A Q13627 1/20 0.57
CLK4 Q9HAZ1 1/20 0.57
KDM4E B2RXH2 1/20 0.55
L3MBTL1 Q9Y468 3/20 0.54
NPC1 O15118 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
GAA P10253 1/20 0.54
LTA4H P09960 1/20 0.53
HIF1A Q16665 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
CRHBP P24387 1/20 0.51
CRHR2 Q13324 1/20 0.51

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
SCHEMBL10054992 0.87 RAB9A (0.83) RAB9APDE4BKDM4EMAPTKMT2A
SCHEMBL2908596 0.84 ALDH1A1 (0.69) RAB9AKDM4EL3MBTL1NPC1MAPT
SCHEMBL26102078 0.84 CYP3A4 (0.58) RAB9ADYRK1ACLK4L3MBTL1NPC1
SCHEMBL25414303 0.84 RAB9A (0.64) RAB9APDE4BKMT2AGAALTA4H
SCHEMBL30520344 0.84 RAB9A (0.64) RAB9APDE4BKMT2AGAALTA4H
SCHEMBL30520217 0.83 RAB9A (0.63) RAB9APDE4BKDM4ENPC1MAPT
SCHEMBL19198137 0.83 RAB9A (0.63) RAB9APDE4BKDM4ENPC1MAPT
SCHEMBL11078808 0.82 SMN1; SMN2 (0.60) RAB9APDE4BKDM4ENPC1MAPT
SCHEMBL19198628 0.82 RAB9A (1.00) RAB9ACLK4KDM4EL3MBTL1NPC1
SCHEMBL5605226 0.82 RAB9A (0.58) RAB9AKDM4EL3MBTL1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230052740-A1 MODULATORS OF CIRCADIAN RHYTHMS AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2023-02-16 US disclosed
US-11214542-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2022-01-04 US disclosed
US-20210009520-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2021-01-14 US disclosed
US-10807956-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-10-20 US disclosed
US-20200172485-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-06-04 US disclosed
US-10597365-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-03-24 US disclosed
US-20190077758-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2019-03-14 US disclosed
US-10179769-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2019-01-15 US disclosed
CN-108976107-A 3- aryl -4- alkoxybenzyl amine derivative and its preparation method and application 南方医科大学 2018-12-11 CN disclosed
CN-107922338-A The pyridine and application method being substituted 艾伯维公司 2018-04-17 CN disclosed
US-20180044296-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-02-15 US disclosed
US-20170298025-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2017-10-19 US disclosed
US-9725441-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-08-08 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 (10 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-20190077758-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-11214542-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-20230052740-A1 MODULATORS OF CIRCADIAN RHYTHMS AND USES THEREOF MTNR1A, PER2, MTNR1B RAB9A 2858/4885PDE4B 448/4885DYRK1A 3680/4885
US-20170298025-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-10179769-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-10807956-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-20180044296-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-20210009520-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-20200172485-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885
US-10597365-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A RAB9A 3032/4885PDE4B 346/4885DYRK1A 4108/4885

“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.