SCHEMBL11224092

SCHEMBL11224092

Nc1ccc(Oc2ccccc2Cl)cc1O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
RCE1 Q9Y256 1/20 0.45
AR P10275 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
XIAP P98170 1/20 0.43
CAMK2A Q9UQM7 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ABL1 P00519 1/20 0.40
ALDH1A1 P00352 1/20 0.39
DPP4 P27487 1/20 0.39
F10 P00742 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
SCHEMBL716943 0.88 GAA (0.52) GAARCE1ARLMNAMAPT
SCHEMBL4841637 0.81 GAA (0.53) GAARCE1LMNAMAPTHTT
SCHEMBL4849002 0.79 GAA (0.47) GAARCE1LMNAMAPTHTT
SCHEMBL8967757 0.78 LTA4H (0.56) HTTXIAPCAMK2AALDH1A1DPP4
SCHEMBL436522 0.78 NR4A1 (0.61) GAAMAPTCYP3A4ALDH1A1
SCHEMBL30040301 0.78 NR4A1 (0.61) GAAMAPTCYP3A4ALDH1A1
SCHEMBL28336683 0.78 NCOA1 (0.61) GAARCE1ARLMNAMAPT
SCHEMBL10775157 0.77 CAMK2A (0.48) ARCAMK2ACYP3A4ALDH1A1DPP4
SCHEMBL564952 0.77 LTA4H (0.59) GAAMAPTCYP3A4ALDH1A1
SCHEMBL30233344 0.77 LTA4H (0.59) GAAMAPTCYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4339462-A BACTERICIDES CIBA-GEIGY CORPORATION (US) 1982-07-13 US disclosed
US-4268693-A 3-Hydroxydiphenyl ethers CIBA-GEIGY CORPORATION (US) 1981-05-19 US disclosed