SCHEMBL2372152

SCHEMBL2372152

Cc1c(C(=O)O)c2cc(Cl)ccc2[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
CSF1R P07333 2/20 0.51
CYP1A2 P05177 1/20 0.50
GAA P10253 1/20 0.50
HPGD P15428 1/20 0.50
KDM4E B2RXH2 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
CHEK1 O14757 1/20 0.48
GRIN2D O15399 2/20 0.48
GRIN3B O60391 2/20 0.48
GRIN1 Q05586 2/20 0.48
GRIN2A Q12879 2/20 0.48
GRIN2B Q13224 2/20 0.48
GRIN2C Q14957 2/20 0.48
GRIN3A Q8TCU5 2/20 0.48
PTGS2 P35354 1/20 0.47
MAP2 P11137 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL8189335 0.88 LMNA (0.51) LMNACSF1RCYP1A2GAAHPGD
SCHEMBL6990287 0.86 KDM4E (0.46) LMNACSF1RHPGDKDM4EALDH1A1
SCHEMBL613136 0.83 LMNA (0.51) LMNACSF1RCYP1A2GAAHPGD
SCHEMBL8889498 0.82 KEAP1 (0.50) LMNAGAAHPGDKDM4EALDH1A1
SCHEMBL8183478 0.81 SIRT1 (0.54) CSF1RHPGDKDM4ESIRT1GRIN2D
SCHEMBL11375916 0.80 KDM4E (0.61) CSF1RCYP1A2KDM4EGRIN2DGRIN3B
SCHEMBL25430492 0.79 SIRT1 (0.52) LMNACSF1RCYP1A2GAAHPGD
SCHEMBL31139832 0.79 SIRT1 (0.52) LMNACSF1RCYP1A2GAAHPGD
SCHEMBL7000905 0.78 CSF1R (0.48) LMNACSF1RCYP1A2GAAHPGD
SCHEMBL4895906 0.78 KDM4E (0.72) LMNACYP1A2GAAHPGDKDM4E

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
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed
US-6114349-A Substituted quinoline derivatives with antiviral action HOECHST AKTIENGESELLSCHAFT (DE) 2000-09-05 US disclosed