SCHEMBL29379396

SCHEMBL29379396

CCCCCCN(N)c1nc2ccc(C)cc2s1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TLR8 Q9NR97 2/20 0.45
▸ KMT2A Q03164 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ APP P05067 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL28683905 1.00 MAPT (0.48) MAPTRAB9ANPSR1TLR8KMT2A
SCHEMBL24086099 0.85 GFER (0.47) MAPTRAB9ANPSR1KMT2AKDM4E
SCHEMBL16705693 0.83 NPC1 (0.50) RAB9ATLR8KDM4EALDH1A1NPC1
SCHEMBL15722637 0.83 NPC1 (0.50) RAB9ATLR8KDM4EALDH1A1NPC1
SCHEMBL15722747 0.83 NPC1 (0.50) RAB9ATLR8KDM4EALDH1A1NPC1
SCHEMBL23185863 0.83 NPC1 (0.50) RAB9ATLR8KDM4EALDH1A1NPC1
SCHEMBL23839400 0.83 MAPT (0.44) MAPTRAB9ANPSR1TLR8KMT2A
SCHEMBL24086123 0.83 CYP1A2 (0.51) RAB9AKMT2AKDM4EALDH1A1NPC1
SCHEMBL24086107 0.82 ALDH1A1 (0.56) MAPTRAB9ANPSR1KMT2AKDM4E
SCHEMBL18369556 0.82 NPC1 (0.51) RAB9ATLR8KDM4EALDH1A1NPC1

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
EP-3990569-B1 NEW POLYMERIZABLE LIQUID CRYSTAL ROLIC TECH AG (CH) 2024-12-04 — — EP disclosed
CN-118702646-A Novel polymerizable liquid crystal 罗利克技术有限公司 2024-09-27 — — CN disclosed
CN-114026078-B Novel polymerizable liquid crystal 罗利克技术有限公司 2024-06-07 — — CN disclosed
EP-3990569-A1 NEW POLYMERIZABLE LIQUID CRYSTAL Rolic Technologies AG (CH) 2022-05-04 — — EP disclosed
CN-114026078-A Novel polymerizable liquid crystal 罗利克技术有限公司 2022-02-08 — — CN disclosed
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