SCHEMBL15528581

SCHEMBL15528581

CCOC(=O)Cc1ccn(C)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
JMJD6 Q6NYC1 2/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
RECQL P46063 1/20 0.43
PKM P14618 1/20 0.42
ATM Q13315 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
TBXAS1 P24557 2/20 0.41
MAPT P10636 1/20 0.39

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
SCHEMBL25056422 0.84 LMNA (0.49) JMJD6MEN1KMT2ANPC1MAPK1
SCHEMBL11108995 0.83 KDM4E (0.42) SMN1; SMN2JMJD6MEN1KMT2ANPC1
SCHEMBL14394389 0.82 SMN1; SMN2 (0.43) SMN1; SMN2MEN1KMT2ARECQLPKM
SCHEMBL16156123 0.77 EPHX2 (0.42) SMN1; SMN2JMJD6KMT2ANPC1RAB9A
SCHEMBL12956415 0.77 SMN1; SMN2 (0.42) SMN1; SMN2JMJD6KMT2ANPC1RAB9A
SCHEMBL2983517 0.75 GLS (0.41) SMN1; SMN2JMJD6NPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL23581663 0.75 EPHX2 (0.41) SMN1; SMN2JMJD6KMT2ANPC1RAB9A
SCHEMBL29014035 0.75 ALDH1A1 (0.56) SMN1; SMN2MEN1KMT2AMAPK1RECQL
SCHEMBL3377744 0.74 TSHR (0.50) SMN1; SMN2JMJD6MEN1KMT2ANPC1
SCHEMBL22170063 0.74 CYP1A2 (0.40) SMN1; SMN2JMJD6NPC1MAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117903140-A Imidazopyrimidines and triazolopyrimidines as A2A/A2B inhibitors 因赛特公司 2024-04-19 CN disclosed
CN-108863850-B Biaryl compound and preparation method and application thereof 复旦大学 2021-05-18 CN disclosed
CN-112384515-A Imidazopyrimidines and triazolopyrimidines as A2A/A2B inhibitors 因赛特公司 2021-02-19 CN disclosed
US-10844017-B2 Biaryl compound, preparation method and use thereof FUDAN UNIVERSITY (CN) 2020-11-24 US disclosed
EP-2844652-B1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH INC (US) 2019-03-13 EP disclosed
CN-108863850-A Biaryl base class compound and its preparation method and application 复旦大学 2018-11-23 CN disclosed
US-9212173-B2 Pyrazole aminopyrimidine derivatives as LRRK2 modulators GENENTECH, INC. (US) 2015-12-15 US disclosed
EP-2844652-A1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS F. Hoffmann-La Roche AG (CH) 2015-03-11 EP disclosed
US-20150051238-A1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH, INC. (CA) 2015-02-19 US disclosed
WO-2013164321-A1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2013-11-07 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 (2 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-10844017-B2 Biaryl compound, preparation method and use thereof RORC, RORB, RORA SMN1; SMN2 4691/4885JMJD6 1637/4885MEN1 4069/4885
US-20150051238-A1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS LRRK2, PARK7, PINK1 SMN1; SMN2 873/4885JMJD6 3616/4885MEN1 4737/4885

“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.