SCHEMBL23729301

SCHEMBL23729301

CC(C)CCOCCCC(=O)NCCCCNI

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.47
CNR1 P21554 4/20 0.43
CNR2 P34972 3/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
PKM P14618 1/20 0.40
NAMPT P43490 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.37
CASP2 P42575 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NAAA Q02083 1/20 0.35
GLP1R P43220 2/20 0.34

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
SCHEMBL23729313 0.84 HPGD (0.46) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL23730062 0.84 HPGD (0.46) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL26700881 0.83 HPGD (0.45) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL26700919 0.83 HPGD (0.45) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL23729309 0.82 HPGD (0.49) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL24253181 0.82 TSHR (0.49) HPGDCNR1CNR2TSHRLMNA
SCHEMBL26709264 0.81 HPGD (0.48) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL23729792 0.80 SMN1; SMN2 (0.56) TSHRSMN1; SMN2ALDH1A1CASP2MEN1
SCHEMBL18707765 0.80 HPGD (0.49) HPGDCNR1CNR2TSHRSMN1; SMN2
SCHEMBL24429252 0.79 HPGD (0.47) HPGDCNR1CNR2TSHRSMN1; SMN2

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-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed