SCHEMBL28638697

SCHEMBL28638697

CCCCC(C)c1ccc(C)cc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.60
LMNA P02545 3/20 0.56
TRPA1 O75762 2/20 0.56
CHRM1 P11229 2/20 0.56
ADRA1A P35348 2/20 0.56
SLC6A2 P23975 1/20 0.56
HTR2B P41595 1/20 0.56
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TP53 P04637 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
NFKB1 P19838 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL29477949 0.98 SRC (0.59) SRCLMNATRPA1CHRM1ADRA1A
Potassium SCHEMBL29477955 0.98 SRC (0.59) SRCLMNATRPA1CHRM1ADRA1A
SCHEMBL30893084 0.95 SRC (0.59) SRCLMNATRPA1CHRM1ADRA1A
SCHEMBL29477968 0.93 SRC (0.57) SRCLMNATRPA1CHRM1ADRA1A
SCHEMBL30893076 0.93 SRC (0.57) SRCLMNATRPA1CHRM1ADRA1A
Potassium SCHEMBL29477960 0.93 SRC (0.57) SRCLMNATRPA1CHRM1ADRA1A
Potassium SCHEMBL29477981 0.92 SRC (0.56) SRCLMNATRPA1CHRM1ADRA1A
SCHEMBL29477990 0.92 SRC (0.56) SRCLMNATRPA1CHRM1ADRA1A
SCHEMBL30893093 0.89 SRC (0.64) SRCLMNATRPA1CHRM1ADRA1A
Potassium SCHEMBL29477971 0.88 SRC (0.62) SRCLMNATRPA1CHRM1ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113423683-B Method for producing 4-hydroxy-2-methylbenzoic acid 本州化学工业株式会社 2024-06-18 CN claimed
CN-113423683-B Method for producing 4-hydroxy-2-methylbenzoic acid 本州化学工业株式会社 2024-06-18 CN disclosed
CN-113423683-A Method for producing 4-hydroxy-2-methylbenzoic acid 本州化学工业株式会社 2021-09-21 CN disclosed