SCHEMBL7989878

SCHEMBL7989878

Cc1ccc(-c2[nH]c(-c3ccc(N4CCCC4)cc3)nc2C(=O)Nc2nccs2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
MAPT P10636 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46
FGFR3 P22607 1/20 0.46
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 2/20 0.43
TSHR P16473 2/20 0.43
POLB P06746 1/20 0.43
AURKA O14965 2/20 0.43
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL7989081 0.91 GAA (0.45) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7977735 0.91 LMNA (0.50) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7989394 0.90 KMT2A (0.53) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7977964 0.90 LMNA (0.49) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7988176 0.90 ALDH1A1 (0.44) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7977725 0.89 FGFR1 (0.42) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7995795 0.89 KMT2A (0.52) GAAMAPTMEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL7977674 0.89 KMT2A (0.51) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7991907 0.86 FGFR1 (0.52) GAAMAPTMEN1KMT2ARAB9A
SCHEMBL7988225 0.85 FGFR1 (0.54) GAAMAPTMEN1KMT2ARAB9A

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed