SCHEMBL17512450

SCHEMBL17512450

CC(C)NC(=O)n1ccnc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.40
QPCT Q16769 1/20 0.39
MAPT P10636 1/20 0.38
HIF1A Q16665 1/20 0.37
CD38 P28907 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP24A1 Q07973 1/20 0.35
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TBXAS1 P24557 2/20 0.34
P2RX4 Q99571 1/20 0.34
KDM4E B2RXH2 1/20 0.34
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTT P42858 1/20 0.33

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
SCHEMBL9913356 0.82 TBXAS1 (0.34) QPCTCD38TBXAS1KDM4E
SCHEMBL9913350 0.82 TBXAS1 (0.34) QPCTCD38TBXAS1KDM4E
SCHEMBL20474442 0.81 MAPT (0.31) MAPTTBXAS1KDM4EFAAHMGLL
SCHEMBL22649178 0.80 AHR (0.33) QPCTTBXAS1KDM4E
SCHEMBL31424313 0.80 HTT (0.34) MAPTCD38HSD17B10PKMTDP1
SCHEMBL28418676 0.79 TBXAS1 (0.33) MAPTCYP24A1TBXAS1KDM4EFAAH
SCHEMBL9913351 0.78 ALDH1A1 (0.35) QPCTMAPTTBXAS1FAAHMGLL
SCHEMBL446876 0.78
SCHEMBL12150031 0.77 CYP26A1 (0.40) MAPTSMN1; SMN2TBXAS1KDM4E
SCHEMBL5647599 0.77 CYP2D6 (0.39) HSD17B10TBXAS1KDM4E

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
US-11197867-B2 Aminopyrimidinyl compounds PFIZER INC. (US) 2021-12-14 US disclosed
US-20210377495-A1 AMINOPYRIMIDINYL COMPOUNDS PFIZER INC. (US) 2021-12-02 US disclosed
WO-2021152393-A1 BIOLUMINESCENT COMPOSITIONS AND USES THEREOF ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) EPFL-DAR-TTO (CH) 2021-08-05 WO disclosed
US-10980815-B2 Aminopyrimidinyl compounds PFIZER INC. (US) 2021-04-20 US disclosed
US-20200330477-A1 AMINOPYRIMIDINYL COMPOUNDS PFIZER INC. (US) 2020-10-22 US disclosed
US-20200038409-A1 AMINOPYRIMIDINYL COMPOUNDS PFIZER INC. (US) 2020-02-06 US disclosed
US-10463675-B2 Aminopyrimidinyl compounds PFIZER INC. (US) 2019-11-05 US disclosed
EP-3183247-B9 AMINOPYRIMIDINYL COMPOUNDS AS JAK INHIBITORS PFIZER (US) 2018-07-25 EP disclosed
EP-3183247-B1 AMINOPYRIMIDINYL COMPOUNDS AS JAK INHIBITORS PFIZER (US) 2017-11-29 EP disclosed
US-20170239264-A1 AMINOPYRIMIDINYL COMPOUNDS PFIZER INC. (US) 2017-08-24 US disclosed
EP-3183247-A1 AMINOPYRIMIDINYL COMPOUNDS AS JAK INHIBITORS Pfizer Inc (US) 2017-06-28 EP disclosed
US-9663526-B2 Aminopyrimidinyl compounds PFIZER INC. (US) 2017-05-30 US disclosed
US-20160052930-A1 AMINOPYRIMIDINYL COMPOUNDS PFIZER INC. (US) 2016-02-25 US disclosed
WO-2016027195-A1 AMINOPYRIMIDINYL COMPOUNDS AS JAK INHIBITORS PFIZER INC. (US) 2016-02-25 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 (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-10463675-B2 Aminopyrimidinyl compounds JAK2, JAK1, JAK3 CYP3A4 2256/4885QPCT 467/4885MAPT 3076/4885
US-11197867-B2 Aminopyrimidinyl compounds CNKSR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SSTR3 CYP3A4 1478/4885QPCT 982/4885MAPT 4732/4885
US-10980815-B2 Aminopyrimidinyl compounds JAK2, JAK1, JAK3 CYP3A4 2256/4885QPCT 467/4885MAPT 3076/4885
US-20200330477-A1 AMINOPYRIMIDINYL COMPOUNDS CNKSR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SSTR3 CYP3A4 1478/4885QPCT 982/4885MAPT 4732/4885
US-20200038409-A1 AMINOPYRIMIDINYL COMPOUNDS CNKSR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR3 CYP3A4 1316/4885QPCT 1093/4885MAPT 4730/4885
US-20170239264-A1 AMINOPYRIMIDINYL COMPOUNDS CNKSR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR3 CYP3A4 1316/4885QPCT 1093/4885MAPT 4730/4885
US-20160052930-A1 AMINOPYRIMIDINYL COMPOUNDS CNKSR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR3 CYP3A4 1316/4885QPCT 1093/4885MAPT 4730/4885

“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.