SCHEMBL29586123

SCHEMBL29586123

CCc1ccn(C2CCCCO2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.40
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2C19 P33261 1/20 0.34
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
GAA P10253 1/20 0.32
YTHDC1 Q96MU7 1/20 0.32
IDH1 O75874 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
ABL1 P00519 1/20 0.30

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
SCHEMBL22381074 0.88 CD274 (0.39) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL18483949 0.86 CD274 (0.43) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL18485036 0.85 CD274 (0.40) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL25232393 0.85 CD274 (0.40) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL22816839 0.83 CD274 (0.40) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL21646747 0.82 CD274 (0.41) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL15519027 0.82 CD274 (0.39) CD274MEN1KMT2ACYP2C19CYP4F2
SCHEMBL31258838 0.81 CD274 (0.39) CD274MEN1KMT2A
SCHEMBL14729661 0.80 RAB9A (0.40) CD274MEN1KMT2ANPC1RAB9A
SCHEMBL31338368 0.80 RXRA (0.45) CD274MEN1KMT2ACYP4F2CYP4A11

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
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 EP disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 WO disclosed