SCHEMBL31465668

SCHEMBL31465668

Cc1cccc(C)c1NC(=O)C(=O)Oc1c(C)cccc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
NFKB1 P19838 1/20 0.45
CYP2C19 P33261 1/20 0.45
NLRP3 Q96P20 1/20 0.44
POLB P06746 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 3/20 0.42
LMNA P02545 3/20 0.42
SCN3A Q9NY46 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42

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
SCHEMBL18415563 0.83 ALDH1A1 (0.59) L3MBTL1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL6430240 0.80 ALDH1A1 (0.70) L3MBTL1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL13779378 0.79 GPR35 (0.61) L3MBTL1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL30019281 0.77 ALDH1A1 (0.44) L3MBTL1ALDH1A1MEN1KMT2APOLB
SCHEMBL31465688 0.75 L3MBTL1 (0.55) L3MBTL1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL3729817 0.75 ALDH1A1 (0.63) L3MBTL1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL7690998 0.75 ALDH1A1 (0.52) L3MBTL1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11170777 0.73 ALDH1A1 (0.61) L3MBTL1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL28613902 0.73 ALDH1A1 (0.61) L3MBTL1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL8764787 0.72 L3MBTL1 (0.55) L3MBTL1ALDH1A1MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025056724-A1 IMINOAMIDE-TYPE COMPOUNDS AS LIGANDS FOR COPPER-CATALYZED COUPLING REACTIONS OF (HETERO)ARYL HALIDES BAYER AKTIENGESELLSCHAFT (DE) 2025-03-20 WO disclosed