SCHEMBL18688681

SCHEMBL18688681

O=C(CS)NCCCCCC(=O)N1CCCc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.57
▸ MAPT P10636 6/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ MAPK1 P28482 2/20 0.51
▸ NPSR1 Q6W5P4 3/20 0.50
▸ LMNA P02545 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ HPGD P15428 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ GRM7 Q14831 1/20 0.48
▸ HDAC6 Q9UBN7 3/20 0.48
▸ HDAC3 O15379 2/20 0.48

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
SCHEMBL18688684 0.81 CHRM2 (0.54) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL18688679 0.81 TSHR (0.55) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL10986812 0.79 TSHR (0.65) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL18668726 0.79 TSHR (0.65) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL10993176 0.79 MAPT (0.68) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL14202790 0.79 SMN1; SMN2 (0.68) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL5107432 0.78 MAPT (0.67) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL1764049 0.78 TSHR (0.70) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL5998943 0.78 HDAC3 (0.70) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL27004621 0.78 SMN1; SMN2 (0.52) TSHRMAPTMEN1KMT2AALDH1A1

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
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 — — US disclosed
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 — — US disclosed
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-02-16 — — US disclosed
US-20210283265-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-09-16 — — US disclosed
US-20210284629-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-09-16 — — US disclosed
US-20210238226-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-08-05 — — US disclosed
US-20210228723-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-07-29 — — US disclosed
WO-2017053360-A1 BICYCLIC AND TRICYCLIC CAP BEARING MERCAPTOACETAMIDE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-03-30 — — 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 (6 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-20210238226-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ATXN2L, ATXN2, ATXN10 TSHR 720/4885MAPT 446/4885MEN1 3416/4885
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 TSHR 3408/4885MAPT 598/4885MEN1 4042/4885
US-20210283265-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 TSHR 3408/4885MAPT 598/4885MEN1 4042/4885
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE CYFIP2, TPX2, ATXN2 TSHR 1535/4885MAPT 1976/4885MEN1 2780/4885
US-20210228723-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ZFX, F13B, GRN TSHR 1565/4885MAPT 3487/4885MEN1 3617/4885
US-20210284629-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, UBQLN2, UBTF TSHR 4174/4885MAPT 301/4885MEN1 4106/4885

“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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