SCHEMBL27782847

SCHEMBL27782847

O=C1c2cc3ccccc3nc2C=CC1Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ ALDH1A1 P00352 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ STAT3 P40763 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32

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
SCHEMBL27816730 0.84 MAPT (0.37) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7088620 0.83 NPC1 (0.39) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL9952010 0.79 TLR8 (0.38) RAB9ANPC1ELANE
SCHEMBL16346102 0.76 NPC1 (0.40) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL7088775 0.76 NPC1 (0.41) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL3735368 0.76 RAB9A (0.45) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL3234460 0.76 NPC1 (0.41) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL9690618 0.76 NPC1 (0.41) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL71079 0.76 NPC1 (0.41) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL3859298 0.76 NPC1 (0.41) RAB9ANPC1ALDH1A1MEN1KMT2A

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
CN-101555226-A N-benzyl-9, 10- dihydro-acridine compound and preparation method thereof UNIV TSINGHUA GRADUATE SCHOOL (CN) 2009-10-14 — — CN disclosed
Send feedback