SCHEMBL30740432

SCHEMBL30740432

C=C(C)CC1CC(CC)C2=C(CCCC2=O)O1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TSHR P16473 2/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
ALOX15 P16050 1/20 0.32
RECQL P46063 1/20 0.32
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PKM P14618 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
SCHEMBL30740435 1.00 TP53 (0.40) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL30740413 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL30740562 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425633 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425639 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425648 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425634 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425661 0.84 TP53 (0.46) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425640 0.81 TP53 (0.38) TP53MEN1KMT2AKDM4ETSHR
SCHEMBL31425645 0.80 TP53 (0.50) TP53MEN1KMT2AKDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4561997-A1 CHROMEN-5-ONE DERIVATIVES FOR USE AS FRAGRANCES Givaudan SA (CH) 2025-06-04 EP claimed
CN-119604490-A Chromen-5-one derivatives for use as fragrances 奇华顿股份有限公司 2025-03-11 CN claimed
WO-2024023169-A1 CHROMEN-5-ONE DERIVATIVES FOR USE AS FRAGRANCES GIVAUDAN SA (CH) 2024-02-01 WO claimed
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