SCHEMBL18220135

SCHEMBL18220135

COCCNS(=O)(=O)/C(C#N)=C/c1ccc(-c2ccc3cc(NCCN4CCOCC4)ccc3c2)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
HPGD P15428 7/20 0.49
KDM4E B2RXH2 7/20 0.49
GAA P10253 5/20 0.49
MAPT P10636 5/20 0.44
LMNA P02545 3/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
USP2 O75604 2/20 0.41
HTT P42858 1/20 0.41
MMP2 P08253 1/20 0.37
MMP8 P22894 1/20 0.37
MMP12 P39900 1/20 0.37
MMP13 P45452 1/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 2/20 0.36
SCN9A Q15858 1/20 0.36
CACNA1B Q00975 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
SCHEMBL25609269 0.91 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL23134359 0.89 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL18220244 0.87 ALDH1A1 (0.42) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL18220134 0.87 ALDH1A1 (0.63) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL17120877 0.86 ALDH1A1 (0.42) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL18219860 0.86 APP (0.44) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL21898281 0.86 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL18220132 0.85 ALDH1A1 (0.53) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL18220186 0.85 CA1 (0.37) ALDH1A1HPGDKDM4EGAAMAPT
SCHEMBL18220154 0.85 MMP2 (0.39) ALDH1A1HPGDKDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208916-A1 AMYLOID TARGETING AGENTS AND METHODS OF USING THE SAME Amydis, Inc. 2024-06-27 US disclosed
US-11718596-B2 Amyloid targeting agents and methods of using the same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-08 US disclosed
US-20210369873-A1 COMPOSITIONS AND METHODS FOR DETECTION OF TRAUMATIC BRAIN INJURY Amydis, Inc. 2021-12-02 US disclosed
US-10005745-B2 Amyloid targeting agents and methods of using the same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-06-26 US disclosed
US-20170248616-A1 IN VITRO COMPOSITIONS COMPRISING HUMAN SAMPLE AND AMYLOID TARGETING AGENT Amydis, Inc. 2017-08-31 US disclosed
US-20160326126-A1 AMYLOID TARGETING AGENTS AND METHODS OF USING THE SAME Amydis, Inc. 2016-11-10 US 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 (5 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-11718596-B2 Amyloid targeting agents and methods of using the same APP, CRYAA, APBA1 ALDH1A1 4151/4885HPGD 4282/4885KDM4E 4807/4885
US-20210369873-A1 COMPOSITIONS AND METHODS FOR DETECTION OF TRAUMATIC BRAIN INJURY S100B, FABP7, CRYAB ALDH1A1 4102/4885HPGD 3606/4885KDM4E 4796/4885
US-20240208916-A1 AMYLOID TARGETING AGENTS AND METHODS OF USING THE SAME APP, CRYAA, APBA1 ALDH1A1 4151/4885HPGD 4282/4885KDM4E 4807/4885
US-20160326126-A1 AMYLOID TARGETING AGENTS AND METHODS OF USING THE SAME APP, APBA1, CRYAA ALDH1A1 4226/4885HPGD 4311/4885KDM4E 4804/4885
US-10005745-B2 Amyloid targeting agents and methods of using the same APP, APBA1, CRYAA ALDH1A1 4226/4885HPGD 4311/4885KDM4E 4804/4885

“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.