SCHEMBL23729309

SCHEMBL23729309

CNCCNC(=O)CCCOCCC(C)C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
ALDH1A1 P00352 1/20 0.43
CNR1 P21554 4/20 0.42
CNR2 P34972 3/20 0.42
LMNA P02545 2/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.38
KISS1R Q969F8 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NAMPT P43490 1/20 0.34
NAAA Q02083 1/20 0.33

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
SCHEMBL26709264 0.86 HPGD (0.48) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL18707765 0.82 HPGD (0.49) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL24429252 0.82 HPGD (0.47) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL23729301 0.82 HPGD (0.47) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL18707764 0.81 HPGD (0.48) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL23729308 0.81 HPGD (0.46) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL18239530 0.81 TSHR (0.38) HPGDALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL23729313 0.81 HPGD (0.46) HPGDALDH1A1CNR1CNR2LMNA
SCHEMBL23730062 0.81 HPGD (0.46) HPGDCNR1CNR2LMNAPKM
SCHEMBL23729787 0.80 SMN1; SMN2 (0.56) ALDH1A1LMNATSHRSMN1; SMN2NAAA

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