SCHEMBL7424199

SCHEMBL7424199

CCCc1c(C(=O)COC)c2ccc(C(N)=O)cc2n1Cc1ccc(Br)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.34
RXFP1 Q9HBX9 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.31
ALOX5AP P20292 1/20 0.31
OXER1 Q8TDS5 1/20 0.31
AGTR1 P30556 1/20 0.31
AGTR2 P50052 1/20 0.31
AKR1A1 P14550 1/20 0.31
AKR1B1 P15121 1/20 0.31
NPC1 O15118 1/20 0.31
ROCK2 O75116 1/20 0.31
ROCK1 Q13464 1/20 0.31

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
SCHEMBL7420896 0.91 LMNA (0.40) PLA2G2ALMNASMN1; SMN2TSHROXER1
SCHEMBL7425576 0.90 MAPT (0.39) PLA2G2ASMN1; SMN2AGTR1AGTR2AKR1A1
SCHEMBL7422341 0.90 TP53 (0.41) PLA2G2ARXFP1SMN1; SMN2TP53
SCHEMBL7423692 0.88 ALOX5AP (0.41) PLA2G2ARXFP1TP53ALOX5AP
SCHEMBL7425567 0.86 ALOX5AP (0.36) PLA2G2ALMNASMN1; SMN2ALOX5APOXER1
SCHEMBL7426123 0.84 SLC22A12 (0.39) PLA2G2ALMNASMN1; SMN2TSHRNPC1
SCHEMBL7426312 0.84 OXER1 (0.36) PLA2G2AOXER1AGTR1AGTR2AKR1A1
SCHEMBL7471716 0.80 ALOX5AP (0.41) PLA2G2ARXFP1LMNATP53ALOX5AP
SCHEMBL7420228 0.80 MAPT (0.38) SMN1; SMN2TP53
SCHEMBL7421847 0.79 ALOX5AP (0.43) PLA2G2ARXFP1TP53ALOX5AP

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 5 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
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