SCHEMBL12957353

SCHEMBL12957353

COC(=O)c1cn(CCO)c2ccc(Cc3cccc(C)c3)cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.46
▸ LMNA P02545 5/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ TP53 P04637 6/20 0.45
▸ MAPT P10636 5/20 0.43
▸ POLB P06746 3/20 0.42
▸ BLM P54132 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ HPGD P15428 1/20 0.41

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
SCHEMBL1043280 0.82 CNR2 (0.42) RXFP1LMNAALDH1A1TP53MAPT
SCHEMBL11948678 0.80 KDM4E (0.47) RXFP1LMNAALDH1A1TP53MAPT
SCHEMBL15085009 0.80 NR4A2 (0.58) LMNAALDH1A1TP53MAPTHPGD
SCHEMBL11948640 0.78 LMNA (0.49) RXFP1LMNAALDH1A1TP53MAPT
SCHEMBL11948674 0.78 LMNA (0.45) LMNAALDH1A1TP53MAPTPOLB
SCHEMBL11948639 0.78 LMNA (0.54) LMNAALDH1A1HPGD
SCHEMBL11948653 0.77 LMNA (0.47) LMNAALDH1A1HPGD
SCHEMBL11948645 0.76 ALDH1A1 (0.48) RXFP1LMNAALDH1A1TP53MAPT
SCHEMBL11948650 0.76 POLB (0.43) RXFP1LMNAALDH1A1TP53MAPT
SCHEMBL11948647 0.76 LMNA (0.46) LMNAALDH1A1HPGD

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-2272516-A2 4-Oxoquinoline compound and use thereof as HIV integrase inhibitor Japan Tobacco, Inc. (JP) 2011-01-12 — — EP disclosed
Send feedback