SCHEMBL14089331

SCHEMBL14089331

CN(C)c1ccc(C2=C/C(=C3\CC/C(=C4\C=C(c5ccc(N(C)C)cc5)CC4)C3=O)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 5/20 0.37
TSHR P16473 3/20 0.37
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 1/20 0.37
MAPT P10636 7/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
WNT3A P56704 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
HPGD P15428 2/20 0.34
NOTUM Q6P988 1/20 0.34
MAPK1 P28482 3/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TNKS O95271 1/20 0.34

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
SCHEMBL14089322 0.83 MAPT (0.41) CYP1A2ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL24923799 0.77 ALDH1A1 (0.44) CYP1A2ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL13700677 0.72 ALDH1A1 (0.42) CYP1A2ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL124209 0.63 ALDH1A1 (0.79) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL11547412 0.63 ALDH1A1 (0.79) ALDH1A1TSHRHSD17B10ALOX15MAPT
Hydrochloric Acid SCHEMBL30448295 0.61 ALDH1A1 (0.73) ALDH1A1TSHRHSD17B10ALOX15MAPT
Hydrochloric Acid SCHEMBL31707017 0.61 ALDH1A1 (0.73) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL65261 0.61 ALDH1A1 (1.00) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL16174610 0.60 MAPT (0.39) CYP1A2ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL8121048 0.60 ALDH1A1 (0.52) CYP1A2ALDH1A1TSHRHSD17B10ALOX15

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
US-20080199811-A1 PHOTOSENSITIVE COMPOSITION AND TWO-PHOTON ABSORPTION PHOTORECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-08-21 US disclosed
US-20080199811-A1 PHOTOSENSITIVE COMPOSITION AND TWO-PHOTON ABSORPTION PHOTORECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-08-21 US disclosed