SCHEMBL9224437

SCHEMBL9224437

COc1cccc(-c2ccc3ocnc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 9/20 0.52
CYP1A2 P05177 9/20 0.52
CYP3A4 P08684 9/20 0.52
CYP2C19 P33261 9/20 0.52
ALDH1A1 P00352 8/20 0.52
USP2 O75604 8/20 0.52
CYP2D6 P10635 8/20 0.52
LMNA P02545 7/20 0.52
MAPK1 P28482 6/20 0.52
TSHR P16473 5/20 0.52
HIF1A Q16665 3/20 0.52
GLA P06280 2/20 0.52
DYRK1A Q13627 2/20 0.51
MAP4K4 O95819 1/20 0.51
NOTUM Q6P988 1/20 0.50
FAAH O00519 1/20 0.49
HSD17B10 Q99714 5/20 0.49
CYP2C9 P11712 4/20 0.49
TP53 P04637 2/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL9197546 0.86 DYRK1A (0.55) CLK4MAPK1DYRK1AMAP4K4FAAH
SCHEMBL926786 0.82 ALDH1A1 (0.48) ALDH1A1LMNADYRK1AKDM4ENPC1
SCHEMBL29475990 0.82 ALDH1A1 (0.48) ALDH1A1LMNADYRK1AKDM4ENPC1
SCHEMBL28048555 0.80 DYRK1A (0.72) CLK4ALDH1A1DYRK1ANPC1RAB9A
SCHEMBL9224654 0.80 DYRK1A (0.55) CLK4ALDH1A1TSHRDYRK1AMAP4K4
SCHEMBL592989 0.79 DYRK1A (0.62) ALDH1A1DYRK1AMAP4K4KDM4ENPC1
SCHEMBL29375136 0.79 DYRK1A (0.62) ALDH1A1DYRK1AMAP4K4KDM4ENPC1
SCHEMBL9222743 0.76 DYRK1A (0.55) CLK4DYRK1AMAP4K4NOTUMCLK1
SCHEMBL3476126 0.76 KLK3 (0.56) DYRK1ATDP1PDGFRBPDGFRAMEN1
SCHEMBL28331613 0.75 PIK3R1 (0.55) CLK4CYP1A2CYP3A4CYP2C19ALDH1A1

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-5422237-A Methine compound and silver halide photographic material comprising the same FUJI PHOTO FILM CO., LTD. (JP) 1995-06-06 US disclosed