SCHEMBL6447013

SCHEMBL6447013

CC(C)C[C@H](NC(=O)CCN)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
KMT2A Q03164 1/20 0.55
FOLH1 Q04609 6/20 0.53
MAPT P10636 1/20 0.51
LAP3 P28838 3/20 0.50
PLA2G2A P14555 2/20 0.47
PLA2G5 P39877 2/20 0.47
GRN P28799 1/20 0.47
SORT1 Q99523 1/20 0.47
MME P08473 1/20 0.47
NTSR1 P30989 1/20 0.46

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
SCHEMBL6447009 1.00 ALDH1A1 (0.58) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL6448243 0.89 ALDH1A1 (0.55) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL6448241 0.89 ALDH1A1 (0.55) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL13451981 0.88 ALDH1A1 (0.46) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL29358824 0.88 ALDH1A1 (0.46) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL65868 0.85 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL29148902 0.85 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL65869 0.85 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL15623775 0.85 ALDH1A1 (0.62) ALDH1A1MEN1LMNAKMT2AFOLH1
Benzene SCHEMBL27688929 0.84 ALDH1A1 (0.56) ALDH1A1MEN1LMNAKMT2AFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117015381-A Novel steroid payloads, steroid linkers, ADCs containing the same and uses thereof 伊穆奈克斯特股份有限公司 2023-11-07 CN claimed
CN-116694480-A Dark She Kongjun S-LWZ20190428-3 and application thereof in preparation of rice fungus grains 中国科学院微生物研究所 2023-09-05 CN claimed
CN-116445299-A Phellinus linteus S-LWZ20210623-1a and application thereof in preparation of rice fungus grains 中国科学院微生物研究所 2023-07-18 CN claimed
US-20240025844-A1 PHENYL UREA ANALOGS AS FORMYL PEPTIDE RECEPTOR 1 (FPR1) SELECTIVE AGONISTS ALLERGAN, INC. 2024-01-25 US disclosed
CN-116694480-A Dark She Kongjun S-LWZ20190428-3 and application thereof in preparation of rice fungus grains 中国科学院微生物研究所 2023-09-05 CN disclosed
CN-116445299-A Phellinus linteus S-LWZ20210623-1a and application thereof in preparation of rice fungus grains 中国科学院微生物研究所 2023-07-18 CN disclosed
US-9877960-B2 Learning and memory improver SUNTORY HOLDINGS LIMITED (JP) 2018-01-30 US disclosed
US-20150297584-A1 LEARNING AND MEMORY IMPROVER SUNTORY HOLDINGS LIMITED (JP) 2015-10-22 US disclosed
WO-2012160713-A1 LEARNING AND MEMORY IMPROVER 4/4)SUNTORY HOLDINGS LIMITED (JP) 2012-11-29 WO disclosed
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP disclosed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 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 (2 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-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 ALDH1A1 889/4885MEN1 2134/4885LMNA 1225/4885
US-20240025844-A1 PHENYL UREA ANALOGS AS FORMYL PEPTIDE RECEPTOR 1 (FPR1) SELECTIVE AGONISTS FPR1, FPR2, FPR3 ALDH1A1 4486/4885MEN1 4782/4885LMNA 3746/4885

“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.