SCHEMBL29048871

SCHEMBL29048871

CC1CCC(C)(C(=O)O)C1(C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 5/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 2/20 0.43
NFKB1 P19838 1/20 0.43
CYP2C19 P33261 1/20 0.43
THPO P40225 1/20 0.43
STAT6 P42226 1/20 0.43
HIF1A Q16665 1/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
MTOR P42345 1/20 0.43
RAB9A P51151 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.40
POLB P06746 1/20 0.38
FFAR3 O14843 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37

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
SCHEMBL10723912 0.80 MAPK1 (0.45) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL2799717 0.80 ALDH1A1 (0.49) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL28493026 0.79 MAPK1 (0.52) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL11267400 0.77 MAPK1 (0.41) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL4635770 0.75 ALDH1A1 (0.41) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL21436919 0.72 NPSR1 (0.47) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL3152534 0.70
SCHEMBL28560684 0.68 P2RX7 (0.37) NPSR1LMNAALDH1A1POLBL3MBTL1
SCHEMBL23092037 0.68 CYP1A2 (0.39) NPSR1MAPK1LMNATP53NFKB1
SCHEMBL19874190 0.67 FFAR3 (0.38) NPSR1MAPK1LMNATP53NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114846049-B Nonaqueous crosslinkable compositions 湛新荷兰有限公司 2024-05-24 CN disclosed
CN-117784522-A Curable composition and method for producing same 株式会社钟化 2024-03-29 CN disclosed
CN-117590688-A Curable composition, cured product thereof, and method for producing same 株式会社钟化 2024-02-23 CN disclosed
CN-117545811-A Non-aqueous crosslinkable compositions 湛新荷兰有限公司 2024-02-09 CN disclosed
CN-116867872-A Adhesive composition, normal temperature curable adhesive and cured product 株式会社钟化 2023-10-10 CN disclosed
CN-113544181-B Non-aqueous crosslinkable compositions 湛新荷兰有限公司 2023-08-08 CN disclosed