SCHEMBL31375880

SCHEMBL31375880

CC(C)(C)OC(=O)NC12CC(CCCO)(C1)C2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
FOLH1 Q04609 3/20 0.41
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
DPP8 Q6V1X1 3/20 0.34
DPP9 Q86TI2 3/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
GAA P10253 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
APLNR P35414 1/20 0.33
EPHX2 P34913 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CACNA1H O95180 1/20 0.31

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
SCHEMBL19373473 0.90 FOLH1 (0.43) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL18697068 0.85 MEN1 (0.42) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL19373169 0.83 MEN1 (0.40) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL24940537 0.83 FOLH1 (0.42) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL23270089 0.82 FOLH1 (0.39) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL23225441 0.81 FOLH1 (0.38) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL25596897 0.80 KMT2A (0.40) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL29935596 0.80 TDP1 (0.37) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL16118673 0.79 MEN1 (0.46) TDP1FOLH1MEN1KMT2AMAPK1
SCHEMBL29470587 0.79 FOLH1 (0.40) TDP1FOLH1MEN1KMT2AMAPK1

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
CN-119390720-B Bicyclo [1.1.1] pentane compound for targeting and combining fibroblast activation protein and application thereof 杭州景嘉航生物医药科技有限公司 2025-04-01 CN disclosed
CN-119390720-A Bicyclo [1.1.1] pentane compound for targeting and combining fibroblast activation protein and application thereof 杭州景嘉航生物医药科技有限公司 2025-02-07 CN disclosed