SCHEMBL7425503

SCHEMBL7425503

CCCc1c(C(=O)C(C)C)c2cc(C(=O)O)ccc2n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 13/20 0.41
EDNRB P24530 10/20 0.40
SLC22A12 Q96S37 1/20 0.39
OXER1 Q8TDS5 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL7427422 0.92 NPC1 (0.37) EDNRAEDNRBSLC22A12HPGD
SCHEMBL7419283 0.90 SMN1; SMN2 (0.41) EDNRAEDNRBSLC22A12HPGDKDM4E
SCHEMBL7417956 0.84 ALOX5AP (0.48) OXER1ALDH1A1HPGDKDM4E
SCHEMBL7424082 0.83 SLC22A12 (0.42) EDNRAEDNRBSLC22A12ALDH1A1HPGD
SCHEMBL7424721 0.82 SLC22A12 (0.57) EDNRAEDNRBSLC22A12ALDH1A1HPGD
SCHEMBL7427199 0.80 SLC22A12 (0.47) EDNRAEDNRBSLC22A12ALDH1A1HPGD
SCHEMBL7422706 0.80 SLC22A12 (0.41) EDNRAEDNRBSLC22A12ALDH1A1MAPK1
SCHEMBL7423832 0.78 SLC22A12 (0.46) EDNRAEDNRBSLC22A12ALDH1A1HPGD
SCHEMBL7418814 0.77 OXER1 (0.41) SLC22A12OXER1ALDH1A1MAPK1
SCHEMBL7427533 0.76 ALOX5AP (0.46) SLC22A12ALDH1A1

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 6 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-6358992-B1 Method of inhibiting neoplastic cells with indole derivatives CELL PATHWAYS, INC. 2002-03-19 US disclosed
US-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed
CN-1187812-A Indole derivatives as CGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 1998-07-15 CN disclosed
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed