SCHEMBL5300377

SCHEMBL5300377

CCCCCCCCCCc1cc[n+](CC)cc1CCCCCCCCCC

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HTT P42858 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ LIPG Q9Y5X9 1/20 0.41
▸ TYR P14679 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALOX5 P09917 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL5290891 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5288397 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5289482 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5294270 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5303201 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5306355 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5283626 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5287144 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5300721 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2
SCHEMBL5292099 1.00 MEN1 (0.46) MEN1TP53MAPTKMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 — — WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 — — WO disclosed
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