SCHEMBL8145307

SCHEMBL8145307

CC(=O)Oc1ccc2c3cccc4c(=O)c(Cc5cccnc5)cn(c2c1)c43

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 4/20 0.36
TSHR P16473 3/20 0.36
EPHX1 P07099 1/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 2/20 0.36
GABRA1 P14867 1/20 0.36
GABRA5 P31644 1/20 0.36
TBXAS1 P24557 1/20 0.35
S1PR3 Q99500 1/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 1/20 0.35
GLS O94925 1/20 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
SCHEMBL6981815 0.89 GABRA1 (0.46) TDP1ALDH1A1KDM4EGAAGABRA1
SCHEMBL8151315 0.86 KDM4E (0.41) PARP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL8144941 0.84 CYP19A1 (0.38) ALDH1A1TSHRKDM4ELMNAHTT
SCHEMBL6979991 0.82 TSHR (0.43) ALDH1A1TSHRKDM4ELMNAHTT
SCHEMBL6968626 0.79 FPR1 (0.39) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL6977976 0.78 CNR2 (0.40) ALDH1A1KDM4EGAATBXAS1HPGD
SCHEMBL7666493 0.77 GABRA1 (0.40) TSHRKDM4ELMNAHTTGABRA1
SCHEMBL6979014 0.77 GABRA1 (0.41) ALDH1A1KDM4EHTTGAAGABRA1
SCHEMBL6968571 0.76 GABRA1 (0.43) ALDH1A1HTTGABRA1GABRA5TBXAS1
SCHEMBL6977266 0.76 CNR1 (0.42) ALDH1A1KDM4ELMNAHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0992240-A1 THERAPEUTIC AGENT FOR ERECTION FAILURE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-04-12 EP disclosed