SCHEMBL30425504

SCHEMBL30425504

C=C(C(=O)OCC)C(O)c1ccccc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 1.00
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RAB9A P51151 1/20 0.41
GPR35 Q9HC97 1/20 0.39
ADRB2 P07550 2/20 0.38
ADRB1 P08588 2/20 0.38
AOC3 Q16853 1/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL15917187 1.00 CASP1 (1.00) CASP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL29184357 0.83 CASP1 (0.71) CASP1MAPTMEN1KMT2AGPR35
SCHEMBL15918360 0.83 CASP1 (0.71) CASP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4632797 0.83 CASP1 (0.70) CASP1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL4632799 0.83 CASP1 (0.70) CASP1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL15916867 0.82 CASP1 (0.70) CASP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL15917866 0.82 CASP1 (0.70) CASP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL15916408 0.81 CASP1 (0.67) CASP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL15918201 0.80 CASP1 (0.67) CASP1ALDH1A1MAPTMEN1KMT2A
SCHEMBL27167055 0.79 CASP1 (0.66) CASP1ALDH1A1ADRB2ADRB1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4398930-A1 IMMUNOMODULATORY COMBINATIONS OF ANTIGEN AND DRUG-LIPID CONJUGATE Integrated Nanotherapeutics Inc. (CA) 2024-07-17 EP claimed
WO-2023035068-A1 IMMUNOMODULATORY COMBINATIONS OF ANTIGEN AND DRUG-LIPID CONJUGATE INTEGRATED NANOTHERAPEUTICS INC. (CA) 2023-03-16 WO claimed
EP-4746880-A2 METHODS OF TREATING DILATED CARDIOMYOPATHY Regencor, Inc. (US) 2026-05-27 EP disclosed
WO-2025024320-A2 METHODS OF TREATING DILATED CARDIOMYOPATHY REGENCOR, INC. (US) 2025-01-30 WO disclosed
EP-4398930-A1 IMMUNOMODULATORY COMBINATIONS OF ANTIGEN AND DRUG-LIPID CONJUGATE Integrated Nanotherapeutics Inc. (CA) 2024-07-17 EP disclosed
WO-2023211929-A1 PROBES AND METHODS FOR TARGETED VISUALIZATION OF NLRP3 INFLAMMASOMES VANDERBILT UNIVERSITY (US) 2023-11-02 WO disclosed
WO-2023035068-A1 IMMUNOMODULATORY COMBINATIONS OF ANTIGEN AND DRUG-LIPID CONJUGATE INTEGRATED NANOTHERAPEUTICS INC. (CA) 2023-03-16 WO disclosed