SCHEMBL4379736

SCHEMBL4379736

[CH2]CCN(CCO)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL79660 0.87 MAPT (0.42) MEN1KMT2AALDH1A1MAPTKDM4E
Water SCHEMBL3302021 0.84 MAPT (0.40) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL12790540 0.84 MAPT (0.40) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17704232 0.82
SCHEMBL22996236 0.77 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17401304 0.77 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL7921722 0.77 FDPS (0.39) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3431851 0.77 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL23736384 0.75 MEN1 (0.35) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL12958611 0.75 ALDH1A1 (0.43) MEN1KMT2AALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158397-A1 TREATMENT OF NEURODEGENERATIVE DISEASES THROUGH INHIBITON OF HSP90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2024-05-16 US claimed
US-11607465-B2 Uses of labeled HSP90 inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2023-03-21 US claimed
US-20230060990-A1 TREATMENT OF NEURODEGENERATIVE DISEASES THROUGH INHIBITON OF HSP90 SLOAN KETTERING INST CANCER RES (US) 2023-03-02 US claimed
US-20210138091-A1 USES OF LABELED HSP90 INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH 2021-05-13 US claimed
CN-106083855-B Purine derivatives useful as Hsp90 inhibitors 斯隆-凯特林癌症研究院 2020-04-10 CN claimed
EP-3208615-B1 USES OF LABELED HSP90 INHIBITORS SLOAN KETTERING INST CANCER RES (US) 2019-10-09 EP claimed
US-10336757-B2 Treatment of neurodegenerative diseases through inhibition of HSP90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2019-07-02 US claimed
US-10201623-B2 HSP90-targeted cardiac imaging and therapy MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2019-02-12 US claimed
US-10172863-B2 Purine derivatives useful as HSP90 inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2019-01-08 US claimed
EP-3305297-A1 TREATMENT OF NEURODEGENERATIVE DISEASES THROUGH INHIBITION OF HSP90 Sloan-Kettering Institute for Cancer Research (US) 2018-04-11 EP claimed
US-20160310497-A1 PURINE DERIVATIVES USEFUL AS HSP90 INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH 2016-10-27 US claimed
US-9328114-B2 Hsp90 inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2016-05-03 US claimed
US-20140378452-A1 Treatment of Neurodegenerative Diseases Through Inhibition of HSP90 NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2014-12-25 US claimed
US-20090298857-A1 Treatment of Neurodegenerative Diseases Through Inhibition of HSP90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2009-12-03 US claimed
US-6686373-B2 ANALGESICS; ANTIINFLAMMATORY AGENT WARNER-LAMBERT COMPANY LLC 2004-02-03 US claimed
US-20030130277-A1 Pyrazoloquinolinone derivatives as protein kinase C inhibitors KAWAMURA KIYOSHI (JP) 2003-07-10 US claimed
EP-1310498-A2 Pyrazoloquinolinone derivatives as protein kinase C inhibitors PFIZER INC. (US) 2003-05-14 EP claimed
US-20240158397-A1 TREATMENT OF NEURODEGENERATIVE DISEASES THROUGH INHIBITON OF HSP90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2024-05-16 US disclosed
US-20030130277-A1 Pyrazoloquinolinone derivatives as protein kinase C inhibitors KAWAMURA KIYOSHI (JP) 2003-07-10 US disclosed
EP-1310498-A2 Pyrazoloquinolinone derivatives as protein kinase C inhibitors PFIZER INC. (US) 2003-05-14 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 (11 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-20030130277-A1 Pyrazoloquinolinone derivatives as protein kinase C inhibitors PRKCB, PRKCA, PRKCG MEN1 4326/4885KMT2A 1579/4885ALDH1A1 3069/4885
US-10336757-B2 Treatment of neurodegenerative diseases through inhibition of HSP90 HSP90AB1, HSP90B1, HSP90AA1 MEN1 4761/4885KMT2A 3897/4885ALDH1A1 1851/4885
US-10172863-B2 Purine derivatives useful as HSP90 inhibitors XDH, HSP90B1, HSP90AA1 MEN1 4847/4885KMT2A 4154/4885ALDH1A1 1795/4885
US-20140378452-A1 Treatment of Neurodegenerative Diseases Through Inhibition of HSP90 HSP90AB1, HSP90B1, HSP90AA1 MEN1 4761/4885KMT2A 3897/4885ALDH1A1 1851/4885
US-20090298857-A1 Treatment of Neurodegenerative Diseases Through Inhibition of HSP90 HSP90AB1, HSP90B1, HSP90AA1 MEN1 4761/4885KMT2A 3897/4885ALDH1A1 1851/4885
US-10201623-B2 HSP90-targeted cardiac imaging and therapy HSP90AB1, HSP90AA1, HSP90B1 MEN1 4411/4885KMT2A 2423/4885ALDH1A1 888/4885
US-20160310497-A1 PURINE DERIVATIVES USEFUL AS HSP90 INHIBITORS XDH, HSP90B1, HSP90AA1 MEN1 4847/4885KMT2A 4154/4885ALDH1A1 1795/4885
US-20240158397-A1 TREATMENT OF NEURODEGENERATIVE DISEASES THROUGH INHIBITON OF HSP90 HSP90B1, HSP90AB1, HSP90AB2P MEN1 4707/4885KMT2A 4309/4885ALDH1A1 1998/4885
US-11607465-B2 Uses of labeled HSP90 inhibitors HSP90AB1, HSP90B1, HSP90AA1 MEN1 4299/4885KMT2A 2799/4885ALDH1A1 1352/4885
US-20230060990-A1 TREATMENT OF NEURODEGENERATIVE DISEASES THROUGH INHIBITON OF HSP90 HSP90B1, HSP90AB1, HSP90AB2P MEN1 4707/4885KMT2A 4309/4885ALDH1A1 1998/4885
US-20210138091-A1 USES OF LABELED HSP90 INHIBITORS HSP90AB1, HSP90B1, HSP90AA1 MEN1 4299/4885KMT2A 2799/4885ALDH1A1 1352/4885

“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.