SCHEMBL30917566

SCHEMBL30917566

CC1OCC(=O)c2cc(Cl)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.37
TYMS P04818 1/20 0.36
MDM2 Q00987 2/20 0.36
AR P10275 1/20 0.36
VHL P40337 1/20 0.36
ELOC Q15369 1/20 0.36
ELOB Q15370 1/20 0.36
GAA P10253 1/20 0.35
PPOX P50336 1/20 0.34
MAPT P10636 3/20 0.34
HTT P42858 3/20 0.34
ALDH1A1 P00352 2/20 0.34
THRB P10828 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HTR2C P28335 2/20 0.33
MAOB P27338 2/20 0.33
CYP19A1 P11511 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2B P41595 1/20 0.33
PKM P14618 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
SCHEMBL30917547 0.80 HTR2C (0.36) TYMSMDM2HTR2CHTR2AHTR2B
SCHEMBL31040911 0.80 ACHE (0.42) HTR2CMAOBCYP19A1
SCHEMBL31040873 0.76 TERT (0.39) HTR2CHTR2AHTR2BTERTSRD5A1
SCHEMBL10696858 0.75 HTR2C (0.44) MDM2GAAHTR2CHTR2AHTR2B
SCHEMBL30917688 0.75 ALDH1A1 (0.44) S100A4MAPTALDH1A1TDP1TERT
SCHEMBL28903977 0.74 S100A4 (0.41) S100A4TYMSARGAAPPOX
SCHEMBL27560253 0.71 VHL (0.44) S100A4TYMSVHLELOCELOB
SCHEMBL31040901 0.70 PBRM1 (0.43) S100A4ARALDH1A1HTR2CHTR2A
SCHEMBL31040926 0.70 ACHE (0.39) HTR2CMAOBHTR2A
SCHEMBL31384990 0.68 AR (0.40) S100A4TYMSARVHLELOC

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-4622716-A1 SPIROCYCLIC DIHYDROPYRANOPYRIMIDINE KRAS INHIBITORS Treeline Biosciences, Inc. (US) 2025-10-01 EP disclosed
WO-2024112654-A1 SPIROCYCLIC DIHYDROPYRANOPYRIMIDINE KRAS INHIBITORS Treeline Biosciences, Inc. (US) 2024-05-30 WO disclosed