SCHEMBL21853322

SCHEMBL21853322

CCCS(=O)(=O)c1cc(Cl)ncn1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 2/20 0.38
ITGA4 P13612 2/20 0.38
LOXL2 Q9Y4K0 1/20 0.35
LMNA P02545 1/20 0.34
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
SLC6A2 P23975 1/20 0.30

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
SCHEMBL5363369 0.87 LOXL2 (0.40) ITGB1ITGA4LOXL2LMNAALDH1A1
SCHEMBL21937640 0.76 ITGB1 (0.36) ITGB1ITGA4LOXL2LMNA
SCHEMBL22608933 0.70 TNNI3K (0.38) LMNA
SCHEMBL27506153 0.70 ITGB1 (0.39) ITGB1ITGA4LOXL2
SCHEMBL17397932 0.68 LMNA (0.40) LOXL2LMNAALDH1A1NPSR1
SCHEMBL14376107 0.68 ENPP1 (0.41) LMNAALDH1A1
SCHEMBL2646780 0.68 PPARD (0.42) LOXL2LMNAALDH1A1NPSR1
SCHEMBL26971207 0.65 CDK2 (0.37) ITGB1ITGA4LOXL2LMNAALDH1A1
SCHEMBL14698006 0.64 CYP2C9 (0.42)
SCHEMBL11277793 0.64 HRH4 (0.44) LMNAALDH1A1

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-20240294520-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE PLIANT THERAPEUTICS INC (US) 2024-09-05 US disclosed
CN-112689507-B Amino acid compounds having unbranched linkers and methods of use thereof 普利安特治疗公司 2024-07-30 CN disclosed
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-20220289743-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE PLIANT THERAPEUTICS, INC. 2022-09-15 US disclosed
US-11396506-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2022-07-26 US disclosed
EP-3813818-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE Pliant Therapeutics, Inc. (US) 2021-05-05 EP disclosed
CN-112689507-A Amino acid compounds having unbranched linkers and methods of use thereof 普利安特治疗公司 2021-04-20 CN disclosed
US-20200123151-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE PLIANT THERAPEUTICS, INC. 2020-04-23 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-11396506-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 ITGB1 3/4885ITGA4 17/4885LOXL2 3376/4885
US-20200123151-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE ITGA2B, ITGB6, ITGB1 ITGB1 3/4885ITGA4 17/4885LOXL2 3376/4885
US-20240294520-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE ITGA2B, ITGB6, ITGB1 ITGB1 3/4885ITGA4 17/4885LOXL2 3376/4885
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 ITGB1 3/4885ITGA4 17/4885LOXL2 3376/4885
US-20220289743-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE ITGA2B, ITGB6, ITGB1 ITGB1 3/4885ITGA4 17/4885LOXL2 3376/4885

“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.