SCHEMBL8296286

SCHEMBL8296286

CCOC(=O)Cn1c(C)cc2cc(C(Cl)c3cccc(Cl)c3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.51
RAB9A P51151 1/20 0.46
ENPP2 Q13822 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.39
KDM4E B2RXH2 4/20 0.38
GSR P00390 1/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL20037044 0.83 TDP1 (0.65) TDP1RAB9AENPP2TSHRALDH1A1
SCHEMBL4478554 0.74 ALDH1A1 (0.57) TDP1RAB9ATSHRALDH1A1MAPT
SCHEMBL1779695 0.74 RAB9A (0.68) TDP1RAB9ATSHRALDH1A1MAPT
SCHEMBL1598783 0.73 ALDH1A1 (0.56) TDP1RAB9ATSHRALDH1A1POLB
SCHEMBL10277241 0.73 RAB9A (0.53) TDP1RAB9ATSHRALDH1A1MAPT
SCHEMBL5190384 0.73 RAB9A (0.53) TDP1RAB9ATSHRALDH1A1MAPT
SCHEMBL4465081 0.72 MAPT (0.57) TDP1RAB9ATSHRALDH1A1POLB
SCHEMBL1467717 0.71 TDP1 (0.51) TDP1ALDH1A1MAPTKDM4EHSD17B10
SCHEMBL7681730 0.70 TDP1 (0.61) TDP1TSHRALDH1A1HSD17B10MEN1
SCHEMBL20037332 0.69 TSHR (0.56) TDP1RAB9AENPP2TSHRALDH1A1

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-0620214-B1 1H-indole-3-acetic acid hydrazide sPLA2 inhibitors LILLY CO ELI (US) 1999-03-03 EP disclosed
US-5578634-A SEPTIC SHOCK TREATMENT ELI LILLY AND COMPANY (US) 1996-11-26 US disclosed
EP-0620214-A1 1H-indole-3-acetic acid hydrazide sPLA2 inhibitors ELI LILLY AND COMPANY (US) 1994-10-19 EP disclosed