SCHEMBL6915834

SCHEMBL6915834

Cc1cc(C(=O)O)c(C)c(C)c1C.[Zn]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
HPGD P15428 3/20 0.45
HSD17B10 Q99714 3/20 0.45
GAA P10253 1/20 0.45
NOTUM Q6P988 1/20 0.43
ALDH1A1 P00352 6/20 0.40
HMGB1 P09429 1/20 0.39
CXCL12 P48061 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39

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
SCHEMBL29769767 0.98 KDM4E (0.48) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL625521 0.98 KDM4E (0.48) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL6916008 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
Phosphine SCHEMBL28160666 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL6913080 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL6914572 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL6908680 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL6913400 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
SCHEMBL6913078 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD
Hydrochloric Acid SCHEMBL11368782 0.95 KDM4E (0.47) KDM4EMEN1KMT2ATDP1HPGD

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