SCHEMBL11079720

SCHEMBL11079720

CSc1nc(=O)c(Cc2ccccc2)c(C)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.56
ALDH1A1 P00352 4/20 0.50
KMT2A Q03164 3/20 0.47
TSHR P16473 2/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 2/20 0.46
HSD17B10 Q99714 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 2/20 0.44
THRB P10828 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ALKBH3 Q96Q83 2/20 0.42
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL14942695 0.81 ALKBH3 (0.45) ALDH1A1KMT2ATSHRMEN1LMNA
SCHEMBL9879442 0.80 ALDH1A1 (0.74) POLBALDH1A1KMT2AMEN1LMNA
SCHEMBL14029140 0.79 ALKBH3 (0.43) POLBALDH1A1KMT2ATSHRMEN1
SCHEMBL10857015 0.79 LMNA (0.70) POLBALDH1A1KMT2ATSHRMEN1
SCHEMBL15359657 0.78 TP53 (0.46) ALDH1A1KMT2ALMNAHSD17B10SMN1; SMN2
SCHEMBL10048197 0.75 ADORA2A (0.50) POLBALDH1A1KMT2ATSHRMEN1
SCHEMBL9829434 0.74 XDH (0.49) POLBALDH1A1LMNASMN1; SMN2CYP2C9
SCHEMBL10735952 0.72 ALDH1A1 (0.73) POLBALDH1A1KMT2ATSHRMEN1
SCHEMBL9879042 0.72 HTT (0.40) ALDH1A1TSHRHTTCYP2C9CYP2C19
SCHEMBL9878574 0.72 POLB (0.61) POLBALDH1A1KMT2ATSHRMEN1

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-4470985-A HISTAMINE H-2 ANTAGONISTS SMITHKLINE & FRENCH LABORATORIES LIMITED (GB) 1984-09-11 US disclosed