SCHEMBL11599341

SCHEMBL11599341

Nc1ccc(Nc2ccc(CSc3ccccc3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
ALDH1A1 P00352 2/20 0.57
HTT P42858 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57
ALOX12 P18054 1/20 0.57
CYP2C19 P33261 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.47
SLC6A4 P31645 1/20 0.45
MAOB P27338 4/20 0.42
MAOA P21397 3/20 0.42
TP53 P04637 1/20 0.42
APP P05067 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
SCHEMBL11600345 0.91 MEN1 (0.60) MAPTALDH1A1HTTALOX12L3MBTL1
SCHEMBL11600667 0.89 MEN1 (0.58) MAPTALDH1A1HTTCYP1A2CYP3A4
SCHEMBL1931351 0.89 MEN1 (0.66) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL3889607 0.81 NPC1 (0.66) ALDH1A1CYP3A4MEN1KMT2ANPC1
SCHEMBL5122923 0.79 ALDH1A1 (0.80) MAPTALDH1A1CYP3A4MEN1KMT2A
SCHEMBL10055053 0.79 ALDH1A1 (0.57) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL5391138 0.79 ALDH1A1 (0.62) MAPTALDH1A1CYP3A4MEN1KMT2A
SCHEMBL31396093 0.76 MAPT (0.75) MAPTALDH1A1HTTCYP1A2CYP3A4
SCHEMBL6405773 0.74 ALDH1A1 (1.00) MAPTALDH1A1HTTCYP1A2CYP3A4
SCHEMBL13644737 0.74 ALDH1A1 (1.00) MAPTALDH1A1HTTCYP1A2CYP3A4

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-4124565-A STABILIZERS, ANTIOXIDANTS, ANTIOZONANTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-11-07 US disclosed