SCHEMBL31235971

SCHEMBL31235971

COc1cc2c(cc1C(=O)O)C1(CCN(Cc3ccccc3)CC1)CO2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 1/20 0.48
S1PR5 Q9H228 9/20 0.48
S1PR1 P21453 2/20 0.46
S1PR3 Q99500 2/20 0.46
SIGMAR1 Q99720 2/20 0.45
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.45
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
DRD2 P14416 2/20 0.43
DRD4 P21917 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL34460295 0.92 S1PR5 (0.46) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL31236031 0.92 S1PR5 (0.46) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL25344327 0.88 S1PR5 (0.51) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL31236079 0.86 SIGMAR1 (0.47) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL25342485 0.85 S1PR5 (0.49) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL31024716 0.85 S1PR5 (0.49) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL31380547 0.82 S1PR5 (0.46) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL31236014 0.81 CRBN (0.49) DRD2DRD4
SCHEMBL26134138 0.81 S1PR5 (0.47) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1
SCHEMBL320767 0.79 SIGMAR1 (0.63) S1PR5S1PR1S1PR3SIGMAR1ALDH1A1

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-4722219-A1 CEREBELLAR PROTEIN E3 UBIQUITIN LIGASE INHIBITOR AND CHIMERIC COMPOUND TARGETING PROTEIN DEGRADATION Gan & Lee Pharmaceuticals Co., Ltd. (CN) 2026-04-08 EP disclosed
WO-2024240268-A1 CEREBELLAR PROTEIN E3 UBIQUITIN LIGASE INHIBITOR AND CHIMERIC COMPOUND TARGETING PROTEIN DEGRADATION 甘李药业股份有限公司 2024-11-28 WO disclosed