SCHEMBL19375412

SCHEMBL19375412

Bc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.71
APOBEC3G Q9HC16 1/20 0.71
TSHR P16473 7/20 0.68
ALDH1A1 P00352 7/20 0.68
HPGD P15428 6/20 0.68
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
MAPK1 P28482 2/20 0.68
POLB P06746 2/20 0.67
TP53 P04637 2/20 0.63
XBP1 P17861 2/20 0.63
BRDT Q58F21 1/20 0.60
HSD17B10 Q99714 6/20 0.59
MAPT P10636 2/20 0.59
KDM1A O60341 1/20 0.59
GAA P10253 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
USP2 O75604 2/20 0.57
BRAF P15056 2/20 0.57
GLA P06280 1/20 0.57

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
SCHEMBL18834052 0.86 ATM (0.72) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16028820 0.85 ATM (0.71) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16028621 0.85 ATM (0.71) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16028236 0.82 ATM (0.67) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16028826 0.81 TSHR (1.00) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16028495 0.79 TSHR (0.67) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL5075029 0.79 POLB (0.84) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16028896 0.79 TSHR (0.84) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL16076250 0.78 ATM (0.62) ATMAPOBEC3GTSHRALDH1A1HPGD
SCHEMBL20652970 0.78 ATM (0.62) ATMAPOBEC3GTSHRALDH1A1HPGD

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
EP-2970303-B9 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-09-20 EP disclosed