SCHEMBL6908359

SCHEMBL6908359

Cc1cc(C)c(C)c(C(=O)O)c1.[Zn]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.61
CSNK2A1 P68400 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
METAP2 P50579 1/20 0.45
ALDH1A1 P00352 2/20 0.44
TPMT P51580 1/20 0.44
NOTUM Q6P988 2/20 0.41
MYC P01106 1/20 0.41
TTR P02766 1/20 0.41
GAA P10253 2/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HCAR1 Q9BXC0 1/20 0.39
HMGB1 P09429 1/20 0.38
CXCL12 P48061 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 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
SCHEMBL1259082 0.98 KDM4E (0.63) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6914424 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6910129 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6914989 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6915536 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6916673 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6915538 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6914098 0.95 KDM4E (0.61) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL3392534 0.85 KDM4E (0.58) KDM4ECSNK2A1MEN1KMT2ATDP1
SCHEMBL6856399 0.80 HMGB1 (0.60) KDM4ECSNK2A1KMT2AMETAP2ALDH1A1

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
US-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed