SCHEMBL1760211

SCHEMBL1760211

CN(C)c1cnc(C(=O)O)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.44
ALDH1A1 P00352 6/20 0.44
ALOX15 P16050 3/20 0.44
HSD17B10 Q99714 2/20 0.44
RXRA P19793 2/20 0.43
RXRB P28702 2/20 0.43
RXRG P48443 2/20 0.43
HCAR2 Q8TDS4 2/20 0.42
NAPRT Q6XQN6 1/20 0.42
P4HTM Q9NXG6 4/20 0.41
P4HA1 P13674 1/20 0.41
MIF P14174 1/20 0.41
HPGD P15428 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPK1 P28482 1/20 0.38
HCAR3 P49019 1/20 0.38
ASPH Q12797 1/20 0.37
KDM8 Q8N371 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL30874226 1.00 KDM4E (0.44) KDM4EALDH1A1ALOX15HSD17B10RXRA
SCHEMBL30874243 0.86 SIRT6 (0.52) KDM4EALDH1A1ALOX15HSD17B10RXRA
SCHEMBL2222631 0.86 SIRT6 (0.52) KDM4EALDH1A1ALOX15HSD17B10RXRA
SCHEMBL17819949 0.83 KCNJ1 (0.41) KDM4EALDH1A1ALOX15HSD17B10RXRA
SCHEMBL17820695 0.80 KDM4E (0.33) KDM4EALDH1A1ALOX15HSD17B10RXRA
SCHEMBL12350232 0.80 P4HTM (0.40) KDM4EALDH1A1ALOX15HSD17B10RXRA
SCHEMBL70035 0.79 KDM4E (0.59) KDM4EALDH1A1ALOX15HSD17B10HCAR2
SCHEMBL17161002 0.79 MAPK1 (0.49) KDM4EALDH1A1HSD17B10HPGDL3MBTL1
SCHEMBL7767700 0.77 KDM4E (0.56) KDM4EALDH1A1ALOX15HSD17B10HCAR2
Water SCHEMBL336347 0.77 KDM4E (0.56) KDM4EALDH1A1ALOX15HSD17B10HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113453764-B 7H-pyrrolo [2,3-d ] pyrimidin-4-amine derivatives 大鹏药品工业株式会社 2024-04-16 CN disclosed
US-11786534-B2 Substituted pyrrolo[2,3-d]pyrimidines as EGFR inhibitors TAIHO PHARMACEUTICAL CO., LTD. (JP) 2023-10-17 US disclosed
US-20220160719-A1 7H-PYRROLO[2,3-D]PYRIMIDINE-4-AMINE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-05-26 US disclosed
EP-3925669-A1 7H-PYRROLO[2,3-D]PYRIMIDINE-4-AMINE DERIVATIVE Taiho Pharmaceutical Co., Ltd. (JP) 2021-12-22 EP disclosed
CN-113453764-A 7H-pyrrolo [2,3-d ] pyrimidin-4-amine derivatives 大鹏药品工业株式会社 2021-09-28 CN disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
EP-3042900-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF Fujifilm Corporation (JP) 2016-07-13 EP disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed
EP-2499121-B1 OXAZOLINE DERIVATIVES FOR TREATMENT OF CNS DISORDERS. HOFFMANN LA ROCHE (CH) 2015-10-07 EP disclosed
US-8354441-B2 Oxazoline derivatives HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US disclosed
EP-2499121-A1 OXAZOLINE DERIVATIVES FOR TREATMENT OF CNS DISORDERS. F. Hoffmann-La Roche AG (CH) 2012-09-19 EP disclosed
CN-102686572-A Oxazoline derivatives for treatment of CNS disorders HOFFMANN LA ROCHE 2012-09-19 CN disclosed
WO-2011057973-A1 OXAZOLINE DERIVATIVES FOR TREATMENT OF CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2011-05-19 WO disclosed
US-20110112080-A1 OXAZOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-05-12 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 (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-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 KDM4E 2666/4885ALDH1A1 2519/4885ALOX15 4709/4885
US-20220160719-A1 7H-PYRROLO[2,3-D]PYRIMIDINE-4-AMINE DERIVATIVE EGFR, ERBB2, ERBB4 KDM4E 789/4885ALDH1A1 1357/4885ALOX15 4573/4885
US-20110112080-A1 OXAZOLINE DERIVATIVES TAAR1, HCRTR1, NPY1R KDM4E 2556/4885ALDH1A1 325/4885ALOX15 2689/4885
US-11786534-B2 Substituted pyrrolo[2,3-d]pyrimidines as EGFR inhibitors EGFR, ERBB2, ERBB3 KDM4E 1631/4885ALDH1A1 2271/4885ALOX15 4765/4885

“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.