SCHEMBL16451454

SCHEMBL16451454

C=C(CC)n1nnc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.56
▸ SLC9A1 P19634 5/20 0.51
▸ GAA P10253 10/20 0.50
▸ MGAM O43451 9/20 0.50
▸ AMY1A P0DUB6 9/20 0.50
▸ SI P14410 9/20 0.50
▸ MGAM2 Q2M2H8 9/20 0.50
▸ F2 P00734 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ MAPK1 P28482 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ ASAH1 Q13510 1/20 0.49
▸ MITF O75030 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ POLB P06746 1/20 0.47
▸ ATM Q13315 1/20 0.47

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
SCHEMBL14362020 0.80 DGAT1 (0.61) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL8228893 0.80 DGAT1 (0.53) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL15426053 0.80 DGAT1 (0.66) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL30219683 0.79 GAA (0.58) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL13134139 0.79 GAA (0.58) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL18675329 0.77 DGAT1 (0.61) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL28836639 0.75 DGAT1 (0.47) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL29728229 0.75 DGAT1 (0.47) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL19496157 0.75 DGAT1 (0.59) DGAT1SLC9A1GAAMGAMAMY1A
SCHEMBL17987937 0.75 DGAT1 (0.59) DGAT1SLC9A1GAAMGAMAMY1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9684293-B2 Refrigerant relief valve monitoring system and method BRT, LLC (US) 2017-06-20 — — US disclosed
US-9233102-B2 Methods and materials for treating cancer MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2016-01-12 — — US disclosed
US-20150045418-A1 METHODS AND MATERIALS FOR TREATING CANCER MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2015-02-12 — — US disclosed
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