SCHEMBL8944049

SCHEMBL8944049

CCCc1cc(O)nc2ncnn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVRL1 P37023 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
ENPP1 P22413 1/20 0.37
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL8943811 0.91 ATM (0.45) ACVRL1ALDH1A1MAPK1LMNACYP1A2
SCHEMBL8944106 0.89 GAA (0.45) ACVRL1ALDH1A1MAPK1LMNACYP1A2
SCHEMBL8943804 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944393 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944401 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944035 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944181 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944386 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944187 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1
SCHEMBL8944134 0.88 GAA (0.47) ALDH1A1MAPK1LMNACYP1A2NPSR1

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-5480716-A MULTILAYER ELEMENT WITH SUPPORT AND MAGNETIC LAYER WITH FERROMAGNETIC METALS FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed