SCHEMBL27737369

SCHEMBL27737369

FC(F)(F)c1ccc(Nc2ccc(-c3ccc(C4CCC(Cn5ncnn5)CC4)cc3)nn2)cn1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 7/20 0.54
▸ ABL1 P00519 1/20 0.39
▸ BCR P11274 1/20 0.39
▸ MEN1 O00255 2/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ SLC34A1 Q06495 1/20 0.33
▸ CHRM2 P08172 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ SCD O00767 2/20 0.32

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
SCHEMBL181294 0.82 DGAT1 (0.58) DGAT1ABL1BCRMEN1NPC1
SCHEMBL181168 0.81 DGAT1 (0.81) DGAT1
SCHEMBL181182 0.81 DGAT1 (0.68) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL180912 0.80 DGAT1 (0.62) DGAT1ABL1BCRMEN1NPC1
SCHEMBL14617042 0.79 DGAT1 (0.54) DGAT1ABL1BCRMEN1NPC1
SCHEMBL13664084 0.79 DGAT1 (0.54) DGAT1ABL1BCRMEN1NPC1
SCHEMBL15445166 0.79 DGAT1 (0.54) DGAT1ABL1BCRMEN1NPC1
SCHEMBL180688 0.79 DGAT1 (0.54) DGAT1ABL1BCRMEN1NPC1
SCHEMBL13664085 0.77 DGAT1 (0.53) DGAT1ABL1BCRMEN1NPC1
SCHEMBL30385270 0.77 DGAT1 (0.53) DGAT1ABL1BCRMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103086981-A New compounds NOVARTIS AG 2013-05-08 — — CN claimed
CN-101415683-A Novel compounds NOVARTIS AG (CH) 2009-04-22 — — CN claimed
CN-103288721-A (4-(4-[6-(trifluoromethyl-pyridin-3-ylamino)-n-containing-heteroaryl]-phenyl)-cyclohexyl)-acetic acid derivatives and pharmaceutical uses thereof NOVARTIS AG 2013-09-11 — — CN disclosed
CN-101415683-B Novel compounds NOVARTIS AG 2013-07-17 — — CN disclosed
CN-103086981-A New compounds NOVARTIS AG 2013-05-08 — — CN disclosed
CN-101415683-A Novel compounds NOVARTIS AG (CH) 2009-04-22 — — CN disclosed
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