Butylbenzyl

Butylbenzyl

SCHEMBL27747950

CCCCc1ccccc1.NCc1ccc(S)cc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.48
LOXL2 Q9Y4K0 1/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 2/20 0.44
HSD11B1 P28845 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KCNH2 Q12809 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CA2 P00918 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
TRPV1 Q8NER1 1/20 0.42

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
SCHEMBL27747930 0.93 HTR2A (0.56) HTR2ALOXL2MAOAMAOBHSD11B1
SCHEMBL27747931 0.93 HTR2A (0.56) HTR2ALOXL2MAOAMAOBHSD11B1
Butylbenzyl SCHEMBL6014428 0.89 LOXL2 (0.61) HTR2ALOXL2MAOAMAOBHSD11B1
Butylbenzyl SCHEMBL27793287 0.85 SIGMAR1 (0.50) MAOAHSD11B1ALDH1A1HPGDHSD17B10
SCHEMBL185753 0.83 CA2 (0.54) HTR2AALDH1A1HPGDHSD17B10CA2
SCHEMBL394855 0.83 HTR2A (0.61) HTR2AALDH1A1HPGDHSD17B10CA2
Benzylamine SCHEMBL6014546 0.82 HTR2A (0.62) HTR2ALOXL2MAOAMAOBALDH1A1
Hydrochloric Acid SCHEMBL920409 0.81 HTR2A (0.59) HTR2AALDH1A1HPGDHSD17B10CA2
Benzenethiol SCHEMBL28859880 0.80 HTR2A (0.56) HTR2AHSD11B1ALDH1A1HSD17B10KCNH2
Benzenethiol SCHEMBL14860439 0.80 HTR2A (0.56) HTR2AHSD11B1ALDH1A1HSD17B10KCNH2

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
CN-101334588-A Chemically amplified positive resist composition SUMITOMO CHEMICAL CO (JP) 2008-12-31 CN disclosed