SCHEMBL21173504

SCHEMBL21173504

CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)c2cccc(Cl)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.41
▸ HTR3E A5X5Y0 1/20 0.41
▸ HTR3B O95264 1/20 0.41
▸ HTR3A P46098 1/20 0.41
▸ HTR3D Q70Z44 1/20 0.41
▸ HTR3C Q8WXA8 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ LMNA P02545 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TAAR1 Q96RJ0 4/20 0.38
▸ HSD11B1 P28845 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RAPGEF3 O95398 1/20 0.36
▸ RAPGEF4 Q8WZA2 1/20 0.36
▸ POLB P06746 1/20 0.35

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
SCHEMBL24399814 0.85 HTR3E (0.38) HDAC6HTR3EHTR3BHTR3AHTR3D
SCHEMBL16325354 0.84 MAPT (0.52) HDAC6HTR3EHTR3BHTR3AHTR3D
SCHEMBL23444947 0.84 CYP2D6 (0.40) MAPTLMNANPC1NPSR1RAB9A
SCHEMBL23117439 0.83 GAA (0.42) LMNANPC1RAB9AKMT2AHTT
SCHEMBL22936150 0.83 GAA (0.39) LMNANPC1RAB9AKMT2AHSD11B1
SCHEMBL14163856 0.83 CYP2D6 (0.44) MAPTLMNANPC1NPSR1RAB9A
SCHEMBL23446406 0.82 TSHR (0.42) HDAC6MAPTNPC1RAB9ACNR1
SCHEMBL6343251 0.81 POLB (0.50) MAPTLMNANPC1NPSR1RAB9A
SCHEMBL8100812 0.81 MAPT (0.48) HDAC6HTR3EHTR3BHTR3AHTR3D
SCHEMBL11521979 0.80 MAPT (0.56) HDAC6HTR3EHTR3BHTR3AHTR3D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190221375-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE SOLUTION, AND OXIDE SEMICONDUCTOR ELECTRODE FUJIFILM CORPORATION (JP) 2019-07-18 — — US disclosed
Send feedback