SCHEMBL17698403

SCHEMBL17698403

NC(=O)OC1(c2ccc(N)cc2)CCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 1/20 0.35
PARP10 Q53GL7 1/20 0.34
LMNA P02545 2/20 0.33
CYP19A1 P11511 9/20 0.33
TBXAS1 P24557 2/20 0.31
AVPR2 P30518 1/20 0.31
AVPR1A P37288 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
CYP3A4 P08684 2/20 0.30
CYP17A1 P05093 1/20 0.30
CYP11A1 P05108 1/20 0.30
PMP22 Q01453 1/20 0.30
PDE4D Q08499 1/20 0.30
PDE3A Q14432 1/20 0.30
NFKB1 P19838 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
SCHEMBL3812202 0.84 HSD11B1 (0.43) ALDH1A1
SCHEMBL3813595 0.84 ALDH1A1 (0.36) ALDH1A1L3MBTL1POLBLMNAMAPT
SCHEMBL26135641 0.84 AKR1C1 (0.44)
SCHEMBL4849593 0.80 PARP15 (0.41) POLBPARP10LMNACYP19A1RAB9A
SCHEMBL11289324 0.80 AKR1C1 (0.48) LMNA
SCHEMBL15258665 0.79 MAPT (0.44) ALDH1A1L3MBTL1POLBLMNAMAPT
SCHEMBL11275197 0.79 AKR1C1 (0.47)
SCHEMBL27878075 0.78 POLB (0.36) ALDH1A1L3MBTL1POLB
SCHEMBL2720271 0.78 GSK3B (0.42)
SCHEMBL2720401 0.76 CA1 (0.37) RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459036-B Process for the preparation of 3- (3- (4- (1-aminocyclobutyl) phenyl) -5-phenyl-3H-imidazo [4,5-b ] pyridin-2-yl) pyridin-2-amine 艾科尔公司 2021-07-16 CN claimed
CN-117486876-A Compounds as inhibitors of Akt kinase 正大天晴药业集团股份有限公司 2024-02-02 CN disclosed
CN-116194452-A Compounds as inhibitors of Akt kinase 正大天晴药业集团股份有限公司 2023-05-30 CN disclosed
CN-106459036-B Process for the preparation of 3- (3- (4- (1-aminocyclobutyl) phenyl) -5-phenyl-3H-imidazo [4,5-b ] pyridin-2-yl) pyridin-2-amine 艾科尔公司 2021-07-16 CN disclosed
CN-111494378-A Compositions and methods for treating proliferative disorders 艾科尔公司 2020-08-07 CN disclosed
CN-107074769-B Compositions and methods for treating proliferative disorders 艾科尔公司 2020-04-07 CN disclosed
US-9850247-B2 Pyrimidopyrimidinones useful as Wee-1 kinase inhibitors ALMAC HOUSE (GB) 2017-12-26 US disclosed
EP-3083625-B1 PYRIMIDOPYRIMIDINONES USEFUL AS WEE-1 KINASE INHIBITORS ALMAC DISCOVERY LTD (GB) 2017-11-01 EP disclosed
CN-107074769-A Compositions and methods for treating proliferative disorders 艾科尔公司 2017-08-18 CN disclosed
US-20160318936-A1 PYRIMIDOPYRIMIDINONES USEFUL AS WEE-1 KINASE INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2016-11-03 US disclosed
EP-2723741-B1 SUBSTITUTED IMIDAZOPYRIDINYL-AMINOPYRIDINE COMPOUNDS ARQULE INC (US) 2016-04-27 EP 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 (1 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-20160318936-A1 PYRIMIDOPYRIMIDINONES USEFUL AS WEE-1 KINASE INHIBITORS WEE1, WEE2, NME1 ALDH1A1 1940/4885L3MBTL1 2612/4885POLB 1298/4885

“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.