SCHEMBL4788962

SCHEMBL4788962

CC(Cc1cnn[nH]1)NC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ LMNA P02545 2/20 0.33
▸ HCAR3 P49019 2/20 0.32
▸ TAAR1 Q96RJ0 1/20 0.32
▸ ITGB2 P05107 1/20 0.31
▸ ICAM1 P05362 1/20 0.31
▸ ITGAL P20701 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ ACACB O00763 2/20 0.31
▸ APAF1 O14727 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL27121679 0.82 CNR1 (0.32) LMNA
SCHEMBL26965364 0.82 CNR1 (0.32) LMNA
SCHEMBL10122822 0.71 ACACB (0.33) ACACB
SCHEMBL8911903 0.71 ACACB (0.33) ACACB
Hydrochloric Acid SCHEMBL28701466 0.71 — —
Hydrochloric Acid SCHEMBL28701463 0.71 — —
SCHEMBL3090354 0.70 CYP1A2 (0.34) —
SCHEMBL14864778 0.70 MME (0.32) ACACB
SCHEMBL14850463 0.70 MME (0.32) ACACB
Hydrochloric Acid SCHEMBL25254223 0.69 SLC22A6 (0.39) LMNA

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
WO-2008147764-A1 MMP INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA, INC. (US) 2008-12-04 — — WO disclosed
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