SCHEMBL31425640

SCHEMBL31425640

C=C(C)C1CC(CC)C2=C(CCCC2=O)O1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.38
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
ALOX15 P16050 2/20 0.30
RECQL P46063 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL30740386 0.84 TP53 (0.38) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL30740383 0.82 TP53 (0.34) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL30740435 0.81 TP53 (0.40) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL30740432 0.81 TP53 (0.40) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL30740430 0.79 TP53 (0.42) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL30740406 0.79 TP53 (0.42) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL30740456 0.79 TP53 (0.42) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL31425661 0.77 TP53 (0.46) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL31425634 0.77 TP53 (0.46) TP53ALDH1A1MEN1KMT2AHPGD
SCHEMBL31425659 0.77 TP53 (0.43) TP53ALDH1A1MEN1KMT2AHPGD

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
CN-119604490-A Chromen-5-one derivatives for use as fragrances 奇华顿股份有限公司 2025-03-11 CN disclosed