SCHEMBL30736841

SCHEMBL30736841

CCOC(=O)c1cnn(Cc2ccccc2C(=O)OC(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
TSHR P16473 2/20 0.40
ALDH1A1 P00352 8/20 0.40
GRM2 Q14416 1/20 0.39
HPGD P15428 3/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.37
BRD4 O60885 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.36
GPR119 Q8TDV5 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
SCHEMBL30736732 0.89 NPBWR1 (0.41) ALDH1A1GRM2HPGDKMT2ALMNA
SCHEMBL27286278 0.87 LMNA (0.37) CRHBPCRHR2ALDH1A1HPGDKMT2A
SCHEMBL30736709 0.87 L3MBTL1 (0.44) CRHBPCRHR2ALDH1A1HPGDLMNA
SCHEMBL27378931 0.86 NPBWR1 (0.43) ALDH1A1HPGDKMT2ALMNAHSD17B10
SCHEMBL27372319 0.82 ADRA1A (0.35) ALDH1A1HPGDLMNAHSD17B10L3MBTL1
SCHEMBL3096725 0.80 ALDH1A1 (0.56) ALDH1A1GRM2HPGDKMT2ALMNA
SCHEMBL31420409 0.80 CRHBP (0.46) CRHBPCRHR2TSHRALDH1A1HPGD
SCHEMBL4767723 0.80 KDM4E (0.49) ALDH1A1GRM2KMT2A
SCHEMBL3606815 0.78 MAPT (0.46) ALDH1A1GRM2HPGDKMT2ALMNA
SCHEMBL6782969 0.78 TSHR (0.49) TSHRALDH1A1HPGDKMT2ALMNA

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
EP-4561575-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 EP disclosed