SCHEMBL13429798

SCHEMBL13429798

COc1ccc(C2(c3ccc(OC)c(C(=O)O)c3)c3cc(S)ccc3-c3ccc(Br)cc32)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ LMNA P02545 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ALDH1A1 P00352 7/20 0.38
▸ MAPT P10636 6/20 0.38
▸ GFER P55789 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ LCK P06239 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ WDR5 P61964 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KDM4E B2RXH2 4/20 0.36
▸ HPGD P15428 1/20 0.36
▸ STAT3 P40763 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ RXFP1 Q9HBX9 1/20 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
SCHEMBL13429802 0.91 MAPT (0.39) POLBLMNANPSR1ALDH1A1MAPT
SCHEMBL12514864 0.85 POLB (0.39) POLBLMNANPSR1ALDH1A1MAPT
SCHEMBL13430031 0.85 POLB (0.37) POLBLMNANPSR1ALDH1A1MAPT
SCHEMBL13429661 0.84 POLB (0.38) POLBLMNANPSR1ALDH1A1MAPT
SCHEMBL13429832 0.83 PTPN11 (0.48) LMNANPSR1ALDH1A1MAPTSMN1; SMN2
SCHEMBL13494976 0.82 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2LCKFYN
SCHEMBL13429819 0.80 CA12 (0.43) LMNAALDH1A1MAPTSMN1; SMN2CYP1A2
SCHEMBL16330293 0.77 HSD17B10 (0.39) POLBLMNANPSR1ALDH1A1MAPT
SCHEMBL13429815 0.76 CYSLTR2 (0.41) LMNANPSR1MAPTSMN1; SMN2KDM4E
SCHEMBL13429662 0.76 HSD17B10 (0.38) POLBLMNANPSR1ALDH1A1MAPT

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-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 — — US disclosed
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 — — US disclosed
Send feedback