SCHEMBL10074964

SCHEMBL10074964

CC(C)(C)OC(=O)N1CC[C@@H](NC2CCCC2)C1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.65
L3MBTL1 Q9Y468 2/20 0.54
THRB P10828 1/20 0.54
ATM Q13315 1/20 0.54
HPGD P15428 1/20 0.49
USP30 Q70CQ3 6/20 0.47
CYP2C9 P11712 1/20 0.47
HSD11B1 P28845 1/20 0.47
ALDH1A1 P00352 3/20 0.47
PARP1 P09874 1/20 0.47
MAPT P10636 2/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
RECQL P46063 1/20 0.43

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
SCHEMBL13696784 1.00 EPHX1 (0.65) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL672100 1.00 EPHX1 (0.65) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL29042871 0.98 EPHX1 (0.68) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL29042873 0.98 EPHX1 (0.68) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL13696785 0.98 EPHX1 (0.68) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL29042876 0.97 EPHX1 (0.61) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL29042880 0.97 EPHX1 (0.61) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL13696786 0.97 EPHX1 (0.61) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL5666472 0.94 EPHX1 (0.57) EPHX1L3MBTL1THRBATMHPGD
SCHEMBL28779709 0.94 EPHX1 (0.57) EPHX1L3MBTL1THRBATMHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116103257-B Reductive amination enzyme mutant and application thereof in synthesis of alkylated pyrrolidine chiral amine 中国科学院天津工业生物技术研究所 2024-10-29 CN disclosed
CN-116103257-A Reductive amination enzyme mutant and application thereof in synthesis of alkylated pyrrolidine chiral amine 中国科学院天津工业生物技术研究所 2023-05-12 CN disclosed
US-10369153-B2 Pyrrolopyrimidine compounds and uses thereof HUTCHISON MEDIPHARMA LIMITED (CN) 2019-08-06 US disclosed
US-10111875-B2 Pyrrolopyrimidine compounds and uses thereof HUTCHINSON MEDIPHARMA LIMITED (CN) 2018-10-30 US disclosed
EP-2606051-B1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LTD (CN) 2016-10-05 EP disclosed
EP-2606051-B1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LTD (CN) 2016-10-05 EP disclosed
US-20160228443-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED 2016-08-11 US disclosed
US-20160228443-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED 2016-08-11 US disclosed
US-20160228443-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED 2016-08-11 US disclosed
US-9346810-B2 Pyrrolopyrimidine compounds and uses thereof HUTCHISON MEDIPHARMA LIMITED (CN) 2016-05-24 US disclosed
US-9346810-B2 Pyrrolopyrimidine compounds and uses thereof HUTCHISON MEDIPHARMA LIMITED (CN) 2016-05-24 US disclosed
US-20130210831-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2013-08-15 US disclosed
US-20130210831-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2013-08-15 US disclosed
WO-2012022045-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2012-02-23 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-20160228443-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF JAK2, JAK1, JAK3 EPHX1 2583/4885L3MBTL1 2995/4885THRB 4564/4885
US-10111875-B2 Pyrrolopyrimidine compounds and uses thereof JAK2, JAK1, JAK3 EPHX1 2583/4885L3MBTL1 2995/4885THRB 4564/4885
US-10369153-B2 Pyrrolopyrimidine compounds and uses thereof JAK2, JAK1, JAK3 EPHX1 2583/4885L3MBTL1 2995/4885THRB 4564/4885
US-20130210831-A1 PYRROLOPYRIMIDINE COMPOUNDS AND USES THEREOF JAK2, JAK1, JAK3 EPHX1 2583/4885L3MBTL1 2995/4885THRB 4564/4885

“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.