SCHEMBL10983263

SCHEMBL10983263

Cc1cccc(-c2ccc(NN)nn2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.43
ALDH1A1 P00352 5/20 0.43
NPC1 O15118 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
NFKB1 P19838 2/20 0.43
NFKB2 Q00653 2/20 0.43
RELA Q04206 2/20 0.43
MAPT P10636 2/20 0.43
IDO1 P14902 1/20 0.42
METAP2 P50579 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM1A O60341 1/20 0.41
XDH P47989 1/20 0.41
HPGD P15428 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL12101270 0.81 ALDH1A1 (0.45) RAB9AALDH1A1NPC1NFKB1NFKB2
SCHEMBL11383906 0.80 MEN1 (0.54) RAB9AALDH1A1NPC1MAPTIDO1
SCHEMBL10983245 0.80 GAA (0.47) RAB9AALDH1A1NPC1SMN1; SMN2NFKB1
SCHEMBL10816679 0.79 RAB9A (0.46) RAB9AALDH1A1NPC1SMN1; SMN2NFKB1
SCHEMBL11244421 0.79 CYP2A6 (0.39) RAB9AALDH1A1NPC1MAPTMEN1
SCHEMBL1752770 0.78 MAPT (0.47) RAB9AALDH1A1NPC1SMN1; SMN2MAPT
SCHEMBL16826158 0.77 RAB9A (0.49) RAB9AALDH1A1NPC1SMN1; SMN2NFKB1
SCHEMBL24359756 0.77 RAB9A (0.49) RAB9AALDH1A1NPC1SMN1; SMN2NFKB1
Hydrochloric Acid SCHEMBL3592354 0.77 MAPT (0.46) RAB9AALDH1A1NPC1SMN1; SMN2MAPT
SCHEMBL3591796 0.76 MAOB (0.47) ALDH1A1IDO1KDM1AXDHHSD17B10

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-4503056-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1985-03-05 US disclosed