SCHEMBL14047400

SCHEMBL14047400

CC1N=C(N2CCN(Cc3ccccc3)C2=O)SC1C(=O)NCc1ccc(F)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 9/20 0.57
▸ TP53 P04637 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.44
▸ TSHR P16473 2/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CACNA1G O43497 1/20 0.41
▸ CACNA1H O95180 1/20 0.41
▸ CACNA1I Q9P0X4 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL14047625 1.00 SCD (0.57) SCDTP53ALDH1A1TSHRRAB9A
SCHEMBL14047539 0.94 SCD (0.53) SCDALDH1A1HPGDHDAC1KMT2A
SCHEMBL14047595 0.90 SCD (0.56) SCDALDH1A1HPGDHDAC1CACNA1G
SCHEMBL14047421 0.90 SCD (0.59) SCDTP53ALDH1A1TSHRRAB9A
SCHEMBL14047409 0.87 SCD (0.47) SCDTP53TSHRRAB9AHDAC1
SCHEMBL14047603 0.86 SCD (0.57) SCDALDH1A1TSHRMEN1KMT2A
SCHEMBL14047404 0.85 SCD (0.47) SCDTP53TSHRRAB9AHDAC1
SCHEMBL14047406 0.84 SCD (0.44) SCDTP53ALDH1A1TSHRMEN1
SCHEMBL14047581 0.83 ALDH1A1 (0.45) SCDALDH1A1RAB9AHPGDMEN1
SCHEMBL14047531 0.83 SCD (0.41) SCDALDH1A1HPGDKMT2ACACNA1G

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-2008127349-A2 HETEROCYCLIC COMPOUNDS SUITABLE FOR THE TREATMENT OF DISEASES RELATED TO ELEVATED LIPID LEVEL NOVARTIS AG (CH) 2008-10-23 — — WO disclosed
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