SCHEMBL6924937

SCHEMBL6924937

Cc1ccc(-c2csc(N)c2C(=O)O)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 6/20 0.53
MAPT P10636 3/20 0.51
POLB P06746 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ALDH1A1 P00352 5/20 0.45
HSD17B10 Q99714 4/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
GRM2 Q14416 1/20 0.42
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.38
KIT P10721 1/20 0.38
KDR P35968 1/20 0.38
FLT3 P36888 1/20 0.38
ANO1 Q5XXA6 1/20 0.38
ALOX15 P16050 1/20 0.37

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
SCHEMBL6927534 0.86 PRKCZ (0.47) PRKCZMAPTPOLBNPSR1ALDH1A1
SCHEMBL6924898 0.83 PRKCZ (0.47) PRKCZALDH1A1GRM2MEN1KMT2A
SCHEMBL6926065 0.81 MPL (0.50) PRKCZNPSR1ALDH1A1HSD17B10HPGD
SCHEMBL12465762 0.79 PRKCZ (0.47) PRKCZMAPTALDH1A1HSD17B10TSHR
SCHEMBL6925553 0.78 MAPT (0.43) PRKCZMAPTPOLBNPSR1ALDH1A1
SCHEMBL13926187 0.77 ALDH1A1 (0.70) PRKCZMAPTPOLBALDH1A1HSD17B10
SCHEMBL14803287 0.74 MEN1 (0.58) MEN1KMT2ANPC1RAB9AANO1
SCHEMBL6925990 0.74 PRKCZ (0.38) PRKCZMAPTPOLBNPSR1ALDH1A1
SCHEMBL28760465 0.73 ALDH1A1 (0.54) PRKCZMAPTPOLBNPSR1ALDH1A1
SCHEMBL6926608 0.71 MEN1 (0.64) HSD17B10TSHRMEN1KMT2ALMNA

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
WO-2011109551-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-09-09 WO disclosed