SCHEMBL23829960

SCHEMBL23829960

NC(=O)OCCCCCCNC(=O)CCl

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
ACHE P22303 12/20 0.42
TSHR P16473 1/20 0.39
FAAH O00519 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CASP2 P42575 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL28340776 1.00 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2ACHETSHRFAAH
SCHEMBL29991209 1.00 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2ACHETSHRFAAH
SCHEMBL28655610 0.98 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2ACHETSHRFAAH
SCHEMBL25286745 0.92 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2ACHETSHRMEN1
SCHEMBL31050436 0.85 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
SCHEMBL28343261 0.84 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2ACHETSHRLMNA
SCHEMBL25282552 0.84 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL28531200 0.84 HDAC3 (0.42) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
SCHEMBL28099785 0.81 HDAC3 (0.40) ALDH1A1SMN1; SMN2ACHETSHRFAAH
SCHEMBL18920948 0.81 FAAH (0.57) ALDH1A1SMN1; SMN2ACHETSHRFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574089-B Photo-induced multifunctional crosslinking agent, preparation method and application thereof 中国科学院上海药物研究所 2023-09-05 CN disclosed
CN-108350062-B Targeted protein degradation to attenuate adverse inflammatory responses associated with adoptive T cell therapy 达纳-法伯癌症研究所股份有限公司 2022-10-14 CN disclosed
CN-113677668-A Bifunctional compounds and methods for androgen receptor targeted ubiquitination 蒙特利诺治疗公司 2021-11-19 CN disclosed
US-20210292298-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR DBD THERAPEUTICS, LLC 2021-09-23 US disclosed
CN-112574089-A Photoinduced multifunctional cross-linking agent, and preparation method and application thereof 中国科学院上海药物研究所 2021-03-30 CN disclosed
CN-111386263-A Modulation of chimeric antigen receptors 达纳-法伯癌症研究所有限公司 2020-07-07 CN disclosed
CN-107257800-B Method for inducing target protein degradation by bifunctional molecules 达纳-法伯癌症研究所股份有限公司 2020-06-30 CN disclosed
CN-110621322-A Modulatable endogenous protein degradation with heterobifunctional compounds 达纳-法伯癌症研究所有限公司 2019-12-27 CN 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 (1 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-20210292298-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 ALDH1A1 2547/4885SMN1; SMN2 4554/4885ACHE 3642/4885

“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.