SCHEMBL10847872

SCHEMBL10847872

NCCSCc1ccc(CNCC2CCCCC2)o1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.47
▸ HDAC6 Q9UBN7 3/20 0.37
▸ ACHE P22303 9/20 0.35
▸ BCHE P06276 7/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ HDAC3 O15379 2/20 0.34
▸ HDAC1 Q13547 2/20 0.34
▸ HDAC8 Q9BY41 2/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ESRRA P11474 1/20 0.33
▸ HDAC2 Q92769 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
SCHEMBL10919123 0.82 PRMT6 (0.48) PRMT6ACHEBCHEALDH1A1SMN1; SMN2
SCHEMBL10857640 0.77 PRMT6 (0.51) PRMT6ACHEBCHE
SCHEMBL11209657 0.77 PRMT6 (0.51) PRMT6ACHEBCHEALDH1A1SMN1; SMN2
SCHEMBL11360362 0.74 PRMT6 (0.55) PRMT6ACHEBCHE
SCHEMBL10849571 0.74 ACHE (0.32) HDAC6ACHEBCHEALDH1A1SMN1; SMN2
SCHEMBL10846891 0.73 PRMT6 (0.50) PRMT6ACHEBCHEALDH1A1MEN1
SCHEMBL11463439 0.73 PRMT6 (0.50) PRMT6ACHEBCHE
SCHEMBL11209167 0.73 PRMT6 (0.50) PRMT6ACHEBCHE
SCHEMBL10741444 0.73 PRMT6 (0.61) PRMT6ACHEBCHE
SCHEMBL10848949 0.72 PRMT6 (0.49) PRMT6ACHEBCHEALDH1A1MEN1

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-4567176-A HISTAMINE H2-ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-01-28 — — US disclosed
Send feedback