SCHEMBL29952467

SCHEMBL29952467

O=Cc1cn(CC(=O)O)c2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
MAPT P10636 2/20 0.66
GAA P10253 1/20 0.66
KMT2A Q03164 5/20 0.61
PTGDR2 Q9Y5Y4 2/20 0.61
MEN1 O00255 2/20 0.61
SMN1; SMN2 Q16637 3/20 0.60
STAT3 P40763 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
POLB P06746 1/20 0.56
NPC1 O15118 1/20 0.56
LMNA P02545 1/20 0.56
HPGD P15428 1/20 0.56
HTT P42858 1/20 0.56
RAB9A P51151 1/20 0.56

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
SCHEMBL1250173 1.00 ALDH1A1 (0.66) ALDH1A1MAPTGAAKMT2APTGDR2
SCHEMBL8690458 0.86 KMT2A (0.65) ALDH1A1MAPTGAAKMT2AMEN1
SCHEMBL30718481 0.86 ALDH1A1 (0.64) ALDH1A1KMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL1520957 0.86 ALDH1A1 (0.64) ALDH1A1KMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL1249875 0.84 CREBBP (0.61) ALDH1A1MAPTKMT2APTGDR2MEN1
SCHEMBL29277395 0.84 ALDH1A1 (0.59) ALDH1A1MAPTGAAKMT2AMEN1
SCHEMBL14450860 0.83 ALDH1A1 (0.61) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL15331580 0.83 MEN1 (0.83) ALDH1A1MAPTKMT2APTGDR2MEN1
SCHEMBL5475563 0.82 ALDH1A1 (0.76) ALDH1A1MAPTGAAKMT2AMEN1
SCHEMBL8265268 0.82 ALDH1A1 (0.65) ALDH1A1MAPTKMT2APTGDR2MEN1

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
EP-4719396-A2 NON-PEPTIDE SMALL MOLECULE FGF14:NAV1.6 CHANNEL COMPLEX PROTEIN-PROTEIN INTERACTION MODULATORS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2026-04-08 EP disclosed
WO-2024254218-A2 NON-PEPTIDE SMALL MOLECULE FGF14:NAV1.6 CHANNEL COMPLEX PROTEIN-PROTEIN INTERACTION MODULATORS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-12-12 WO disclosed
WO-2023049816-A9 BIFUNCTIONAL MOLECULES AND METHODS OF USING THEREOF FLAGSHIP PIONEERING, INC. (US) 2023-04-27 WO disclosed
WO-2023049816-A2 BIFUNCTIONAL MOLECULES AND METHODS OF USING THEREOF FLAGSHIP PIONEERING, INC. (US) 2023-03-30 WO disclosed
EP-4126063-A1 BIFUNCTIONAL MOLECULES AND METHODS OF USING THEREOF Flagship Pioneering, Inc. (US) 2023-02-08 EP disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed