SCHEMBL5328384

SCHEMBL5328384

CC(C)N1C=CN(Cc2ccccc2)C1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
ABCB1 P08183 2/20 0.35
MEN1 O00255 1/20 0.34
ELANE P08246 1/20 0.34
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
GLA P06280 1/20 0.34
FUCA1 P04066 1/20 0.33
ACHE P22303 1/20 0.33
CYP19A1 P11511 1/20 0.33

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
SCHEMBL5288332 0.83 TSHR (0.37) KMT2AALDH1A1NPSR1MAPTTSHR
SCHEMBL7137668 0.82 SIGMAR1 (0.41) KMT2ATSHRABCB1MEN1ELANE
SCHEMBL5292198 0.81 DRD2 (0.38) KMT2AALDH1A1NPSR1MAPTTSHR
SCHEMBL5329132 0.81 KMT2A (0.34) KMT2AALDH1A1NPSR1MAPTMEN1
SCHEMBL5329882 0.80 TSHR (0.44) KMT2AALDH1A1NPSR1MAPTTSHR
SCHEMBL5322094 0.80 ACHE (0.42) KMT2AALDH1A1NPSR1MAPTGLA
SCHEMBL5328428 0.79 ALDH1A1 (0.36) KMT2AALDH1A1NPSR1MAPTMEN1
SCHEMBL5304804 0.78 MEN1 (0.36) KMT2AALDH1A1NPSR1MAPTTSHR
SCHEMBL5284758 0.78 ELANE (0.37) ALDH1A1NPSR1TSHRABCB1ELANE
SCHEMBL5296270 0.78 MC4R (0.38) ALDH1A1NPSR1TSHRABCB1ELANE

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