SCHEMBL5317401

SCHEMBL5317401

CCc1nc2cc(C(=O)O)ccc2n1-c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.73
PTGER4 P35408 2/20 0.59
HTT P42858 1/20 0.56
THRB P10828 2/20 0.56
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
POLB P06746 2/20 0.55
PABPC1 P11940 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SIRT2 Q8IXJ6 2/20 0.55
SIRT1 Q96EB6 2/20 0.55
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
FGFR1 P11362 1/20 0.50
LMNA P02545 1/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CRBN Q96SW2 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
SCHEMBL6445182 0.90 HSD17B10 (0.59) HSD17B10PTGER4KMT2AMEN1POLB
SCHEMBL4256918 0.87 THRB (0.77) HSD17B10PTGER4HTTTHRBKMT2A
SCHEMBL22371434 0.86 HSD17B10 (0.65) HSD17B10PTGER4HTTTHRBKMT2A
SCHEMBL120600 0.85 HSD17B10 (1.00) HSD17B10PTGER4HTTTHRBKMT2A
SCHEMBL29784251 0.85 HSD17B10 (1.00) HSD17B10PTGER4HTTTHRBKMT2A
SCHEMBL25112562 0.81 PDE10A (0.63) SIRT2SIRT1ALDH1A1FGFR1
SCHEMBL2696717 0.81 HSD17B10 (0.58) HSD17B10PTGER4HTTTHRBSMN1; SMN2
SCHEMBL22160864 0.80 HSD17B10 (0.51) HSD17B10PTGER4HTTTHRBKMT2A
SCHEMBL3950784 0.80 TP53 (0.50) HSD17B10PTGER4HTTKMT2AMEN1
SCHEMBL1356520 0.80 HSD17B10 (0.48) HSD17B10PTGER4THRBKMT2AMEN1

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-2007069053-A1 BENZIMIDAZOLE ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-06-21 WO disclosed