SCHEMBL23802451

SCHEMBL23802451

COCCCCCC(=O)NCC(C)C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.55
TSHR P16473 1/20 0.55
ALDH1A1 P00352 1/20 0.50
EPHX2 P34913 4/20 0.44
RECQL P46063 1/20 0.44
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
FAAH O00519 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
MMP1 P03956 1/20 0.40
MMP8 P22894 1/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL22447940 0.93 HPGD (0.62) HPGDTSHRALDH1A1EPHX2RECQL
SCHEMBL14577252 0.85 HPGD (0.53) HPGDTSHRALDH1A1EPHX2RECQL
SCHEMBL26700591 0.84 HPGD (0.50) HPGDALDH1A1EPHX2RECQLKMT2A
SCHEMBL26700589 0.84 HPGD (0.50) HPGDALDH1A1EPHX2RECQLKMT2A
SCHEMBL101437 0.83 HPGD (0.56) HPGDTSHREPHX2RECQLHTT
SCHEMBL20668574 0.82 TSHR (0.55) HPGDTSHRALDH1A1RECQLHTT
SCHEMBL23729802 0.82 HPGD (0.51) HPGDALDH1A1EPHX2RECQLSMN1; SMN2
SCHEMBL23729800 0.81 HPGD (0.48) HPGDEPHX2RECQLSMN1; SMN2CYP2D6
SCHEMBL19477902 0.81 TSHR (0.50) HPGDTSHRALDH1A1RECQLHTT
SCHEMBL8468908 0.81 GAA (0.47) HPGDTSHRALDH1A1RECQLHTT

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-2021178725-A1 COMPOSITIONS AND METHODS FOR TARGETED RNA DELIVERY VERVE THERAPEUTICS, INC. (US) 2021-09-10 WO disclosed