SCHEMBL7424082

SCHEMBL7424082

CCCc1c(C(C)=O)c2ccc(C(=O)O)cc2n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.42
EDNRA P25101 8/20 0.41
EDNRB P24530 5/20 0.38
ALDH1A1 P00352 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL7426853 0.92 SLC22A12 (0.40) SLC22A12EDNRAEDNRBALDH1A1CA12
SCHEMBL7423537 0.90 MEN1 (0.40) SLC22A12EDNRAALDH1A1MAPK1SMN1; SMN2
SCHEMBL7422706 0.88 SLC22A12 (0.41) SLC22A12EDNRAEDNRBALDH1A1MAPK1
SCHEMBL7707715 0.85 SLC22A12 (0.42) SLC22A12EDNRAEDNRBALDH1A1CA12
SCHEMBL7425503 0.83 EDNRA (0.41) SLC22A12EDNRAEDNRBALDH1A1MAPK1
SCHEMBL150104 0.83 L3MBTL1 (0.47) SLC22A12ALDH1A1MEN1KMT2AFABP4
SCHEMBL7427382 0.82 SLC22A12 (0.39) SLC22A12EDNRAEDNRBALDH1A1MAPK1
SCHEMBL7418953 0.81 EDNRA (0.39) SLC22A12EDNRAEDNRBALDH1A1CYP1A2
SCHEMBL7429126 0.81 MEN1 (0.40) SLC22A12EDNRAALDH1A1MAPK1SMN1; SMN2
SCHEMBL7426123 0.81 SLC22A12 (0.39) SLC22A12EDNRAEDNRBMAPK1SMN1; SMN2

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-0820441-B1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2002-06-26 EP disclosed
US-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed