SCHEMBL11052071

SCHEMBL11052071

CCc1ccccc1OC(C)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.64
CYP1A2 P05177 1/20 0.50
GAA P10253 1/20 0.50
CYP2C9 P11712 1/20 0.50
PKM P14618 1/20 0.50
CYP2C19 P33261 1/20 0.50
POLB P06746 2/20 0.49
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
PLA2G2A P14555 2/20 0.45
PLA2G10 O15496 1/20 0.45
PLA2G1B P04054 1/20 0.45
PLA2G5 P39877 1/20 0.45
PLA2G2F Q9BZM2 1/20 0.45
PLA2G2E Q9NZK7 1/20 0.45
PLA2G2D Q9UNK4 1/20 0.45
TSHR P16473 2/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL7087891 0.88 KMT2A (0.62) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL4849966 0.88 KMT2A (0.62) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL7934338 0.88 KMT2A (0.62) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL11049410 0.85 KMT2A (0.55) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL10983124 0.85 KMT2A (0.58) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL3966231 0.84 KMT2A (0.54) KMT2AHSD17B10KDM4EALDH1A1HPGD
SCHEMBL29129795 0.83 THRA (0.56) KMT2A
SCHEMBL289123 0.82 KMT2A (0.55) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL23615905 0.81 KMT2A (0.67) KMT2ACYP1A2GAACYP2C9PKM
SCHEMBL10767214 0.81 L3MBTL1 (0.42) KMT2AADRA2AADRA2BADRA2CTSHR

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
EP-0055357-B1 PROCESS FOR THE PREPARATION OF CHLORINATED PHENOXYALKANOIC ACIDS BASF Aktiengesellschaft (DE) 1984-01-11 EP claimed
CN-101107226-B Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB 2012-01-18 CN disclosed
CN-101107226-A Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB (SE) 2008-01-16 CN disclosed