SCHEMBL18338385

SCHEMBL18338385

CC1(C)CCn2nccc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL18338406 0.81 SMN1; SMN2 (0.34) CYP1A2KDM4EALDH1A1GLAGAA
SCHEMBL14248952 0.69 CYP1A2 (0.39) CYP1A2ALDH1A1GAA
SCHEMBL1180242 0.68 CYP1A2 (0.38) CYP1A2
SCHEMBL15473978 0.67
SCHEMBL15473960 0.64 CYP1A2 (0.40) CYP1A2ALDH1A1GAA
SCHEMBL4497137 0.64
SCHEMBL4207853 0.64 CDC7 (0.50) ALDH1A1GAA
SCHEMBL20939379 0.63 HRH3 (0.34)
SCHEMBL14249389 0.63 CYP1A2 (0.35) CYP1A2GAA
SCHEMBL14249114 0.63 CYP1A2 (0.35) CYP1A2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117015539-A Aminopyridine derivative, preparation method and application thereof 成都苑东生物制药股份有限公司 2023-11-07 CN disclosed
WO-2023179597-A1 AMINOPYRIDINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 成都苑东生物制药股份有限公司 2023-09-28 WO disclosed
US-20220340592-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2022-10-27 US disclosed
CN-108948019-B Focal adhesion kinase inhibitors and uses thereof 广东东阳光药业有限公司 2022-07-08 CN disclosed
US-11352369-B2 Pyridine and pyrimidine derivatives ASTRAZENECA AB (SE) 2022-06-07 US disclosed
US-11352369-B2 Pyridine and pyrimidine derivatives ASTRAZENECA AB (SE) 2022-06-07 US disclosed
EP-3539961-B1 POLYCYCLIC AMIDE DERIVATIVES AS CDK9 INHIBITORS ASTRAZENECA AB (SE) 2021-10-06 EP disclosed
EP-3539961-B1 POLYCYCLIC AMIDE DERIVATIVES AS CDK9 INHIBITORS ASTRAZENECA AB (SE) 2021-10-06 EP disclosed
US-20210171541-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2021-06-10 US disclosed
US-20210171541-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2021-06-10 US disclosed
EP-3313838-B1 POLYCYCLIC AMIDE DERIVATIVES AS CDK9 INHIBITORS ASTRAZENECA AB (SE) 2019-04-03 EP disclosed
US-20180093998-A1 CHEMICAL COMPOUNDS ASTRAZENECA PHARMACEUTICALS LP 2018-04-05 US disclosed
US-20180093998-A1 CHEMICAL COMPOUNDS ASTRAZENECA PHARMACEUTICALS LP 2018-04-05 US disclosed
US-20180093998-A1 CHEMICAL COMPOUNDS ASTRAZENECA PHARMACEUTICALS LP 2018-04-05 US disclosed
US-9845331-B2 Chemical compounds ASTRAZENECA AB (SE) 2017-12-19 US disclosed
US-9845331-B2 Chemical compounds ASTRAZENECA AB (SE) 2017-12-19 US disclosed
US-9845331-B2 Chemical compounds ASTRAZENECA AB (SE) 2017-12-19 US disclosed
WO-2017001354-A1 POLYCYCLIC AMIDE DERIVATIVES AS CDK9 INHIBITORS ASTRAZENECA AB (SE) 2017-01-05 WO disclosed
US-20160376287-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-12-29 US disclosed
US-20160376287-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-12-29 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 (5 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-20220340592-A1 CHEMICAL COMPOUNDS CDK9, BCL9, BCL9L CYP1A2 3573/4885KDM4E 489/4885ALDH1A1 4269/4885
US-20210171541-A1 CHEMICAL COMPOUNDS CDK9, BCL9, BCL9L CYP1A2 3573/4885KDM4E 489/4885ALDH1A1 4269/4885
US-20160376287-A1 Chemical Compounds CDK9, BCL9, BCL9L CYP1A2 3573/4885KDM4E 489/4885ALDH1A1 4269/4885
US-20180093998-A1 CHEMICAL COMPOUNDS CDK9, BCL9, BCL9L CYP1A2 3573/4885KDM4E 489/4885ALDH1A1 4269/4885
US-11352369-B2 Pyridine and pyrimidine derivatives CDK9, BCL9, CDK19 CYP1A2 3506/4885KDM4E 509/4885ALDH1A1 4308/4885

“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.