SCHEMBL10130720

SCHEMBL10130720

CCN1CCN(C(C)C)CC1=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AOC2 O75106 1/20 0.37
▸ P2RX7 Q99572 2/20 0.36
▸ PIK3CD O00329 3/20 0.33
▸ GAA P10253 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ VCP P55072 1/20 0.32
▸ DAO P14920 1/20 0.32
▸ KCNH2 Q12809 2/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ MAOB P27338 4/20 0.31
▸ HRH3 Q9Y5N1 1/20 0.31
▸ IDH1 O75874 1/20 0.31

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
SCHEMBL24300045 0.85 AOC2 (0.36) AOC2P2RX7PIK3CDL3MBTL1VCP
SCHEMBL22387991 0.82 PIK3CD (0.53) AOC2P2RX7PIK3CDGAAL3MBTL1
SCHEMBL21740018 0.82 AOC2 (0.36) AOC2PIK3CDGAAL3MBTL1ALDH1A1
SCHEMBL23608301 0.82 P2RX7 (0.38) P2RX7GAAL3MBTL1
SCHEMBL10130746 0.82 PIK3CD (0.40) PIK3CDGAAL3MBTL1ALDH1A1THRB
SCHEMBL29344874 0.79 AOC2 (0.37) AOC2PIK3CDVCPDAOKCNH2
SCHEMBL21124357 0.78 AOC2 (0.34) AOC2PIK3CDVCP
SCHEMBL10250897 0.78 LMNA (0.39) AOC2ALDH1A1KCNH2HRH3
SCHEMBL23108919 0.77 KDM4E (0.34) AOC2PIK3CDALDH1A1VCPDAO
SCHEMBL10250697 0.77 TSHR (0.50) AOC2P2RX7PIK3CDKCNH2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023109521-A1 PARP INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 凯复(苏州)生物医药有限公司 2023-06-22 — — WO disclosed
WO-2023098656-A1 COMPOUNDS FOR THE DEGRADATION OF EGFR KINASE BEIGENE, LTD. (GB) 2023-06-08 — — WO disclosed
US-20230146870-A1 METHOD TO QUANTIFY AFFINITY AND SELECTIVITY OF SMALL MOLECULES FOR PROTEINS IN LIVING CELLS OHIO STATE INNOVATION FOUNDATION 2023-05-11 — — US disclosed
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES Epizyme, Inc. (US) 2023-05-04 — — US disclosed
US-20220073522-A1 Substituted Pyrazolo[3,4-d]Pyrimidines as Kinase Inhibitors PRINCIPIA BIOPHARMA INC. (US) 2022-03-10 — — US disclosed
US-11230534-B2 KDM1A inhibitors for the treatment of disease IMAGO BIOSCIENCES, INC. (US) 2022-01-25 — — US disclosed
US-11225493-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2022-01-18 — — US disclosed
EP-3322706-B1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-11-11 — — EP disclosed
US-20200283397-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. 2020-09-10 — — US disclosed
US-20200277312-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2020-09-03 — — US disclosed
WO-2020132597-A1 COMPOUNDS THAT PARTICIPATE IN COOPERATIVE BINDING AND USES THEREOF Revolution Medicines, Inc. (US) 2020-06-25 — — WO disclosed
EP-3181567-B1 PYRAZOLOPYRIMIDINE COMPOUNDS AS KINASE INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2019-03-20 — — EP disclosed
WO-2018136661-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRAZINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-07-26 — — WO disclosed
US-9994576-B2 Substituted pyrazolo[3,4-d]pyrimidines as kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2018-06-12 — — US disclosed
US-8906913-B2 Azabicyclohexanes PANACEA BIOTEC LIMITED (IN) 2014-12-09 — — US disclosed
US-20120165320-A1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2012-06-28 — — US disclosed
US-20110160196-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2011-06-30 — — US disclosed
US-20080293704-A1 FACTOR Xa INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2008-11-27 — — 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 (9 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-20080293704-A1 FACTOR Xa INHIBITORS TFPI, F12, F11 AOC2 551/4885P2RX7 1813/4885PIK3CD 1373/4885
US-20200277312-A1 IMMUNOPROTEASOME INHIBITORS PSMC2, PSMB7, PSMB2 AOC2 3345/4885P2RX7 3197/4885PIK3CD 3272/4885
US-20110160196-A1 FACTOR XA INHIBITORS TFPI, F12, F11 AOC2 551/4885P2RX7 1813/4885PIK3CD 1373/4885
US-20200283397-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1B, KDM1A, KDM2A AOC2 4120/4885P2RX7 4745/4885PIK3CD 3056/4885
US-11230534-B2 KDM1A inhibitors for the treatment of disease KDM1B, KDM1A, KDM2A AOC2 4120/4885P2RX7 4745/4885PIK3CD 3056/4885
US-11225493-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 AOC2 3345/4885P2RX7 3197/4885PIK3CD 3272/4885
US-20120165320-A1 NOVEL AZABICYCLOHEXANES CYP3A43, UGT1A1, CYP3A4 AOC2 2927/4885P2RX7 2068/4885PIK3CD 2320/4885
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 AOC2 3780/4885P2RX7 3251/4885PIK3CD 2093/4885
US-20220073522-A1 Substituted Pyrazolo[3,4-d]Pyrimidines as Kinase Inhibitors BTK, SYK, LCK AOC2 3122/4885P2RX7 421/4885PIK3CD 32/4885

“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.

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