SCHEMBL23714713

SCHEMBL23714713

C[C@]1(C#N)CCNc2ccc(C(=O)O)cc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 12/20 0.55
RARG P13631 11/20 0.55
RARA P10276 8/20 0.55
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
CYP26A1 O43174 3/20 0.40
CYP26B1 Q9NR63 1/20 0.40
RXRA P19793 7/20 0.40
RXRB P28702 6/20 0.40
RXRG P48443 4/20 0.40
ALK Q9UM73 1/20 0.38
CYP3A4 P08684 2/20 0.37
CRABP2 P29373 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL23714715 1.00 RARB (0.55) RARBRARGRARAKDM4EMAPT
SCHEMBL23714891 0.79 RARB (0.55) RARBRARGRARAKDM4EMAPT
SCHEMBL23714634 0.79 RARB (0.36) RARBRARGRARAKDM4EMAPT
SCHEMBL23714890 0.77 RARB (0.36) RARBRARGRARAHSPA9
SCHEMBL23705405 0.77 KDM1A (0.51) RARBRARGRARAKDM4EMAPT
SCHEMBL23705297 0.73 RARB (0.54) RARBRARGRARACYP26A1CYP26B1
SCHEMBL23706054 0.73 RARB (0.54) RARBRARGRARACYP26A1CYP26B1
SCHEMBL30042835 0.73 RARB (0.54) RARBRARGRARACYP26A1CYP26B1
SCHEMBL23706073 0.73 RARB (0.54) RARBRARGRARACYP26A1CYP26B1
SCHEMBL30041725 0.73 RARB (0.54) RARBRARGRARACYP26A1CYP26B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021155320-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed
WO-2021155316-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed