SCHEMBL360212

SCHEMBL360212

CN(CC1=NN(CC2CCCCC2)C(=O)C1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HTR2C P28335 2/20 0.32
▸ SLC6A4 P31645 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ ABCC1 P33527 1/20 0.31
▸ SIGMAR1 Q99720 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
SCHEMBL360468 0.99 KMT2A (0.38) KMT2AKDM4EMEN1ALDH1A1SMN1; SMN2
SCHEMBL361566 0.96 KMT2A (0.35) KMT2AKDM4EMEN1ALDH1A1PDE4B
SCHEMBL360068 0.93 CNR2 (0.33) KMT2AKCNH2HRH3CNR2
SCHEMBL14917010 0.88 CNR2 (0.31) KMT2ACNR2
SCHEMBL360066 0.87 SMN1; SMN2 (0.36) KMT2AKDM4EMEN1ALDH1A1SMN1; SMN2
SCHEMBL14917056 0.87 KMT2A (0.30) KMT2A
SCHEMBL14953070 0.86 P2RX7 (0.31) —
SCHEMBL14917312 0.85 KCNH2 (0.31) KCNH2HRH3
SCHEMBL10080296 0.85 HTR2C (0.48) KMT2AHTR2CSLC6A4PDE4BCNR1
SCHEMBL10079903 0.83 HTR2C (0.47) KMT2AHTR2CSLC6A4PDE4BCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11312688-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-04-26 — — US disclosed
US-20200308119-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2020-10-01 — — US disclosed
US-10723703-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-07-28 — — US disclosed
US-20190084938-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2019-03-21 — — US disclosed
US-10183913-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-01-22 — — US disclosed
US-10087146-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-10-02 — — US disclosed
US-20180273489-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2018-09-27 — — US disclosed
US-20170217902-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2017-08-03 — — US disclosed
US-9663472-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-05-30 — — US disclosed
EP-2594559-B1 PYRAZOLE COMPOUND SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2016-02-24 — — EP disclosed
US-20140315971-A1 PYRAZOLE COMPOUND NEUROINNOVATECH APS (DK) 2014-10-23 — — US disclosed
US-8809383-B2 Pyrazole compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-08-19 — — US disclosed
US-20140031406-A1 PYRAZOLE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-01-30 — — US disclosed
EP-2594559-A1 PYRAZOLE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2013-05-22 — — EP disclosed
CN-103097357-A Pyrazole compound DAINIPPON SUMITOMO PHARMA CO 2013-05-08 — — CN disclosed
WO-2012008528-A1 PYRAZOLE COMPOUND 大日本住友製薬株式会社 (JP) 2012-01-19 — — 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 (10 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-20140315971-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-10183913-B2 Pyrazole compound HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-20170217902-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-11312688-B2 Pyrazole compound HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-20200308119-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-10723703-B2 Pyrazole compound HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-20180273489-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-20190084938-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-10087146-B2 Pyrazole compound HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885
US-20140031406-A1 PYRAZOLE COMPOUND HTR2C, HTR3B, HTR3A KMT2A 2238/4885KDM4E 2490/4885MEN1 3975/4885

“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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