SCHEMBL14047406

SCHEMBL14047406

CC1N=C(N2C(=O)N(Cc3ccc(F)cc3)CC2O)SC1C(=O)NCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.41
▸ CACNA1I Q9P0X4 9/20 0.41
▸ CACNA1G O43497 8/20 0.41
▸ CACNA1H O95180 8/20 0.41
▸ TSHR P16473 1/20 0.40
▸ TP53 P04637 2/20 0.40
▸ LMNA P02545 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ P2RX7 Q99572 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ HTT P42858 1/20 0.37

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 0.84 SCD (0.57) SCDMEN1KMT2AALDH1A1CACNA1I
SCHEMBL14047400 0.84 SCD (0.57) SCDMEN1KMT2AALDH1A1CACNA1I
SCHEMBL14047577 0.83 KMT2A (0.43) SCDMEN1KMT2AALDH1A1TSHR
SCHEMBL14047605 0.82 SCD (0.47) SCDMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL14047539 0.78 SCD (0.53) SCDKMT2AALDH1A1CACNA1ICACNA1G
SCHEMBL13393741 0.78 SCD (0.49) SCDALDH1A1TSHR
SCHEMBL243843 0.75 SCD (0.71) SCD
SCHEMBL14047421 0.75 SCD (0.59) SCDMEN1KMT2AALDH1A1TSHR
SCHEMBL14047595 0.74 SCD (0.56) SCDALDH1A1CACNA1ICACNA1GCACNA1H
SCHEMBL14047409 0.72 SCD (0.47) SCDTSHRTP53LMNAMAPT

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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