SCHEMBL28700425

SCHEMBL28700425

CCOC(=O)C1(NC(=O)OC(C)(C)C)CC(OCC)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.32
GHSR Q92847 1/20 0.32
CTSL P07711 1/20 0.32
HCRTR2 O43614 1/20 0.32
CPB2 Q96IY4 1/20 0.32
CACNA1H O95180 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 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
SCHEMBL10039978 0.89 EPHX2 (0.37) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL9914311 0.89 EPHX2 (0.37) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL28700335 0.86 KMT2A (0.35) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL15826780 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL15257504 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL15306516 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL12173239 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL298008 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL10040060 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1
SCHEMBL13525930 0.86 KMT2A (0.38) KMT2AALDH1A1MEN1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119823001-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-15 CN disclosed
CN-114206832-B Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-04 CN disclosed
CN-114206832-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2022-03-18 CN disclosed