SCHEMBL24352196

SCHEMBL24352196

CCC(/C=C(\C)C=O)=C\c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
TSHR P16473 1/20 0.61
LMNA P02545 1/20 0.53
TDP1 Q9NUW8 1/20 0.51
RECQL P46063 1/20 0.45
AKR1C3 P42330 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HTT P42858 1/20 0.40
FBP1 P09467 1/20 0.40
NR1I2 O75469 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
KDM1A O60341 1/20 0.38
MTNR1A P48039 2/20 0.37
MTNR1B P49286 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 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
SCHEMBL20441154 0.87 LMNA (0.58) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL3337166 0.83 LMNA (0.66) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL8924634 0.83 LMNA (0.66) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL629156 0.83 LMNA (0.66) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL20441151 0.83 LMNA (0.75) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL13825216 0.80 ALDH1A1 (0.80) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL18586974 0.79 AKR1C3 (0.61) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL230809 0.77 ALDH1A1 (1.00) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL186778 0.77 ALDH1A1 (1.00) ALDH1A1TSHRLMNATDP1RECQL
SCHEMBL891311 0.77 ALDH1A1 (1.00) ALDH1A1TSHRLMNATDP1RECQL

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
EP-3573944-B1 COMPOUNDS REDUCING MALODOUR PERCEPTION AND THE USE THEREOF CHEMCOM SA (BE) 2022-03-02 EP disclosed