SCHEMBL12034091

SCHEMBL12034091

CCCn1c(O)c(Cc2ccccc2)c(O)c(N=Nc2cc(C)c(CC)cn2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.42
▸ HPGD P15428 5/20 0.42
▸ LMNA P02545 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ HTT P42858 4/20 0.36
▸ TP53 P04637 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ LDHA P00338 1/20 0.34
▸ LDHB P07195 1/20 0.34
▸ IDH1 O75874 1/20 0.33
▸ KMT2A Q03164 7/20 0.33
▸ MAPT P10636 5/20 0.33
▸ MEN1 O00255 5/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NR1I2 O75469 1/20 0.33
▸ CASR P41180 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ USP2 O75604 1/20 0.33

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
SCHEMBL12034303 0.73 ALDH1A1 (0.43) KDM4EHPGDLMNAALDH1A1POLB
SCHEMBL9804432 0.56 BCL2 (0.48) KDM4EHPGDALDH1A1HSD17B10TP53
SCHEMBL11258337 0.55 PLA2G2A (0.55) KDM4EHPGDLMNAALDH1A1POLB
SCHEMBL11423904 0.54 CASR (0.56) KDM4EHPGDLMNAALDH1A1POLB
SCHEMBL11247239 0.54 IDH1 (0.41) KDM4EHPGDALDH1A1POLBTP53
SCHEMBL18729640 0.54 LDHA (0.58) KDM4EALDH1A1POLBSMN1; SMN2LDHA
SCHEMBL10724101 0.54 IDH1 (0.60) KDM4EHPGDALDH1A1POLBHSD17B10
SCHEMBL3524860 0.54 CYP2C9 (0.50) KDM4EHPGDLMNAALDH1A1POLB
SCHEMBL4473176 0.54 KMT2A (0.54) KDM4EHPGDLMNAALDH1A1POLB
SCHEMBL11435794 0.54 MEN1 (0.49) KDM4ELMNAALDH1A1POLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309196-B2 Optical recording medium, optical recording material and metal complex compound MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2012-11-13 — — US disclosed
US-20110311752-A1 OPTICAL RECORDING MEDIUM, OPTICAL RECORDING MATERIAL AND METAL COMPLEX COMPOUND MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2011-12-22 — — US disclosed
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