SCHEMBL6909967

SCHEMBL6909967

O=C(O)c1cccc2cccc(Cl)c12.[GaH3]

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
HSD17B10 Q99714 2/20 0.68
TSHR P16473 2/20 0.68
KDM4E B2RXH2 1/20 0.68
RXFP1 Q9HBX9 1/20 0.68
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
PBRM1 Q86U86 2/20 0.47
CYP1A2 P05177 2/20 0.46
ALOX15 P16050 1/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
USP2 O75604 1/20 0.45
MT-CO2 P00403 1/20 0.45
LMNA P02545 1/20 0.45
TTR P02766 1/20 0.45
PLA2G1B P04054 1/20 0.45

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
SCHEMBL6909969 1.00 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL5664709 0.98 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6916682 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6913595 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6915789 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6915788 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6916678 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6916880 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6918684 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL6915887 0.96 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AHSD17B10TSHR

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