SCHEMBL8207281

SCHEMBL8207281

Cc1nc2c(C(=O)O)cnn2c(Cl)c1CCCl

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.55
HSD17B10 Q99714 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
GAA P10253 1/20 0.55
TSHR P16473 1/20 0.55
ALDH1A1 P00352 8/20 0.49
HPGD P15428 6/20 0.49
TP53 P04637 6/20 0.42
LMNA P02545 6/20 0.42
MAPT P10636 4/20 0.42
DPP4 P27487 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL8191387 0.87 TP53 (0.57) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL8184450 0.86 KDM4E (0.49) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL8188664 0.84 TP53 (0.43) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL8176463 0.83 MAPT (0.43) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL8198899 0.83 KDM4E (0.42) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL8199073 0.82 ALDH1A1 (0.45) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL9215707 0.81 DPP4 (0.34) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL22796688 0.81 HSD17B10 (0.67) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL9213889 0.80 GSK3B (0.36) KDM4EHSD17B10SMN1; SMN2GAATSHR
SCHEMBL9205154 0.76 KDM5A (0.54) KDM4EHSD17B10SMN1; SMN2GAAALDH1A1

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
EP-1021447-A1 PYRROLOPYRAZOLOPYRIMIDINE COMPOUND AND MEDICINE COMPRISING THE SAME POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-07-26 EP disclosed
WO-1998033799-A1 PYRROLOPYRAZOLOPYRIMIDINE COMPOUND AND MEDICINE COMPRISING THE SAME POLA CHEMICAL INDUSTRIES, INC. (JP) 1998-08-06 WO disclosed