SCHEMBL10035906

SCHEMBL10035906

Cc1cc(N)ccc1N1CCC2(CCN(C)CC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.61
MAPT P10636 7/20 0.61
GAA P10253 5/20 0.61
KMT2A Q03164 3/20 0.61
PTK2B Q14289 3/20 0.61
MEN1 O00255 2/20 0.61
THRB P10828 2/20 0.61
NR4A1 P22736 1/20 0.61
RAD52 P43351 2/20 0.54
GFER P55789 2/20 0.54
KDM4E B2RXH2 5/20 0.50
LMNA P02545 1/20 0.45
ALOX15 P16050 1/20 0.45
POLB P06746 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ADRA2C P18825 3/20 0.39
HTT P42858 2/20 0.39
ESR2 Q92731 1/20 0.39
MAPK1 P28482 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL187881 0.85 ALDH1A1 (0.71) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL29477783 0.85 ALDH1A1 (0.71) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL26418611 0.84 HTR1A (0.49) ALDH1A1MAPTGAAKMT2AMEN1
SCHEMBL23126590 0.83 MAPT (0.54) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL31397762 0.81 ALDH1A1 (0.61) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL15358737 0.81 MAPT (0.81) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL10126783 0.81 MAPT (0.65) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL23126654 0.81 DRD2 (0.48) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL24123866 0.80 HRH3 (0.39) ALDH1A1MAPTGAAKMT2APTK2B
SCHEMBL15651152 0.80 ALDH1A1 (0.55) ALDH1A1MAPTGAAKMT2APTK2B

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
US-11691974-B2 3,9-diazaspiro[5,5]undecane compound as FLT3 and AXL inhibitors MEDSHINE DISCOVERY INC. (CN) 2023-07-04 US disclosed
US-11691974-B2 3,9-diazaspiro[5,5]undecane compound as FLT3 and AXL inhibitors MEDSHINE DISCOVERY INC. (CN) 2023-07-04 US disclosed
US-20230141887-A1 CRYSTAL FORM OF DIAZASPIROPYRAN COMPOUND MEDSHINE DISCOVERY INC. (CN) 2023-05-11 US disclosed
US-20230141887-A1 CRYSTAL FORM OF DIAZASPIROPYRAN COMPOUND MEDSHINE DISCOVERY INC. (CN) 2023-05-11 US disclosed
US-20210395252-A1 3,9-DIAZASPIRO[5,5]UNDECANE COMPOUND AS FLT3 AND AXL INHIBITORS MEDSHINE DISCOVERY INC. (CN) 2021-12-23 US disclosed
EP-3572413-B1 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDIN-3-ONE DERIVATIVE AS WEE1 INHIBITOR SHIJIAZHUANG SAGACITY NEW DRUG DEV CO LTD (CN) 2021-11-03 EP disclosed
EP-3858819-A1 3,9- DIAZASPIRO[5,5] UNDECANE COMPOUND AS FLT3 AND AXL INHIBITORS Medshine Discovery Inc. (CN) 2021-08-04 EP disclosed
US-10954253-B2 1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one derivative as Wee1 inhibitor Shijiazhuang Sagacity New Drug Development Co., Ltd. (CN) 2021-03-23 US disclosed
WO-2020063856-A1 3,9- DIAZASPIRO[5,5] UNDECANE COMPOUND AS FLT3 AND AXL INHIBITORS 南京明德新药研发有限公司 2020-04-02 WO disclosed
WO-2012053606-A1 ARYLAMINOHETEROCYCLIC CARBOXAMIDE COMPOUND アステラス製薬株式会社 (JP) 2012-04-26 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 (4 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-20210395252-A1 3,9-DIAZASPIRO[5,5]UNDECANE COMPOUND AS FLT3 AND AXL INHIBITORS FLT3, AXL, TYRO3 ALDH1A1 1665/4885MAPT 3594/4885GAA 1778/4885
US-10954253-B2 1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one derivative as Wee1 inhibitor WEE1, WEE2, CCNE1 ALDH1A1 2046/4885MAPT 4482/4885GAA 2857/4885
US-11691974-B2 3,9-diazaspiro[5,5]undecane compound as FLT3 and AXL inhibitors FLT3, AXL, TYRO3 ALDH1A1 1665/4885MAPT 3594/4885GAA 1778/4885
US-20230141887-A1 CRYSTAL FORM OF DIAZASPIROPYRAN COMPOUND GOT1, ORMDL3, PKD1 ALDH1A1 1925/4885MAPT 1913/4885GAA 1610/4885

“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.