SCHEMBL1263347

SCHEMBL1263347

C=Cc1ccc(Cn2/c(=N\N=c3\sc4cc(S(=O)(=O)O)ccc4n3C)sc3ccccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.41
▸ RAB9A P51151 5/20 0.41
▸ SMN1; SMN2 Q16637 5/20 0.41
▸ MAPT P10636 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ KMT2A Q03164 6/20 0.41
▸ TRPM5 Q9NZQ8 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ PSMD14 O00487 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ MC4R P32245 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CTDSP1 Q9GZU7 1/20 0.38

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
SCHEMBL1263348 1.00 NPC1 (0.41) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
Tetrabuthylammonium SCHEMBL1263694 0.92 TSHR (0.41) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL1263701 0.87 MAPT (0.46) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL1263700 0.87 MAPT (0.46) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
Tetrabuthylammonium SCHEMBL5550079 0.84 TSHR (0.40) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
Tetrabuthylammonium SCHEMBL5550075 0.84 TSHR (0.40) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL12898254 0.79 NPC1 (0.40) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL18785100 0.77 ALDH1A1 (0.47) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL1679319 0.77 ALDH1A1 (0.47) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL15849845 0.77 ALDH1A1 (0.47) NPC1RAB9ASMN1; SMN2MAPTALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190315988-A1 CO-POLYMERS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LTD (GB) 2019-10-17 — — US disclosed
US-8435696-B2 Redox-active polymers and their applications BROWN UNIVERSITY (US) 2013-05-07 — — US disclosed
US-20110031440-A1 REDOX-ACTIVE POLYMERS AND THEIR APPLICATIONS BROWN UNIVERSITY 2011-02-10 — — US disclosed
US-7838687-B2 Redox-active polymers and their applications BROWN UNIVERSITY (US) 2010-11-23 — — US disclosed
US-20070048608-A1 Redox-active polymers and their applications BROWN UNIVERSITY 2007-03-01 — — US disclosed
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