SCHEMBL7974247

SCHEMBL7974247

Cc1cccc(Cn2cnc3nc(-c4cccc(O)c4)nc(O)c32)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.44
CYP11B2 P19099 3/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 2/20 0.39
HSD17B13 Q7Z5P4 1/20 0.39
HPGD P15428 3/20 0.39
TSHR P16473 3/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37
ADORA1 P30542 2/20 0.36

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
SCHEMBL7974268 0.91 CYP11B1 (0.48) CYP11B1CYP11B2ALDH1A1LMNAHPGD
SCHEMBL7991557 0.90 LMNA (0.43) CYP11B1CYP11B2ALDH1A1LMNAHPGD
SCHEMBL7985565 0.90 HDAC6 (0.40) CYP11B1CYP11B2LMNAHSD17B13HTT
SCHEMBL7988958 0.89 ALDH1A1 (0.42) CYP11B1CYP11B2ALDH1A1LMNAHPGD
SCHEMBL7975240 0.89 ALDH1A1 (0.42) CYP11B1CYP11B2ALDH1A1LMNAHPGD
SCHEMBL7988594 0.89 TP53 (0.44) CYP11B1CYP11B2ALDH1A1HPGDSMN1; SMN2
SCHEMBL7985336 0.89 PIK3CA (0.42) CYP11B1CYP11B2ALDH1A1HSD17B13HPGD
SCHEMBL7985378 0.88 TSHR (0.47) CYP11B1CYP11B2ALDH1A1LMNAHPGD
SCHEMBL7988747 0.87 CYP11B1 (0.44) CYP11B1CYP11B2ALDH1A1LMNAHPGD
SCHEMBL7991646 0.87 SMN1; SMN2 (0.43) HSD17B13HTTSMN1; SMN2ADORA1ADORA2A

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
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed