SCHEMBL6046232

SCHEMBL6046232

Cc1cc(C(=O)O)c(CCC(C)C)c(N)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
IKBKE Q14164 1/20 0.35
TBK1 Q9UHD2 1/20 0.35
GABRP O00591 2/20 0.35
GABRD O14764 2/20 0.35
GABRA1 P14867 2/20 0.35
GABRB1 P18505 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRB3 P28472 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRA3 P34903 2/20 0.35
GABRA2 P47869 2/20 0.35
GABRB2 P47870 2/20 0.35
GABRA4 P48169 2/20 0.35
GABRE P78334 2/20 0.35
GABRA6 Q16445 2/20 0.35
GABRG1 Q8N1C3 2/20 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
SCHEMBL8938795 0.88 KDM4E (0.44) KDM4EKMT2AMEN1TDP1IKBKE
SCHEMBL8462262 0.86 KDM4E (0.45) KDM4EKMT2AMEN1TDP1IKBKE
SCHEMBL9998049 0.79 KDM4E (0.46) KDM4EKMT2AMEN1TDP1GABRP
SCHEMBL27490519 0.77 KDM4E (0.43) KDM4EIKBKETBK1NOS3NOS1
SCHEMBL27447625 0.75 GRIN2D (0.39) KMT2AMEN1TDP1GRM1BRS3
SCHEMBL27385302 0.74 THRA (0.32) KDM4EGRM1HSD17B10GAAHPGD
SCHEMBL6682995 0.73 KDM4E (0.53) KDM4EKMT2AMEN1TDP1GABRP
SCHEMBL28482651 0.73 KDM4E (0.59) KDM4EKMT2AMEN1TDP1GABRP
SCHEMBL4608098 0.71 CYP1A2 (0.41) KDM4ETDP1IKBKETBK1HSD17B10
SCHEMBL5161218 0.70 SMPD1 (0.39) KDM4ETDP1HSD17B10HPGDBRS3

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
US-20060279865-A1 Optical element, retardation plate using same, optical laminated body,and display apparatus DAI NIPPON PRINTING CO., LTD. (JP) 2006-12-14 US disclosed