SCHEMBL29524907

SCHEMBL29524907

CC1(C)OB(c2ccc(Cl)c(OC(F)F)c2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPL P06858 11/20 0.41
LIPG Q9Y5X9 11/20 0.41
AAK1 Q2M2I8 1/20 0.38
EGFR P00533 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
KCNH2 Q12809 1/20 0.35
CSF1R P07333 1/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2B Q13224 2/20 0.34
BACE1 P56817 1/20 0.34
ESR2 Q92731 1/20 0.33
RXRA P19793 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
SCHEMBL2412403 1.00 LPL (0.41) LPLLIPGAAK1EGFRCA1
SCHEMBL365686 0.88 AAK1 (0.45) LPLLIPGAAK1EGFRCA1
SCHEMBL16290518 0.84 LPL (0.45) LPLLIPGEGFRCA1CA2
SCHEMBL2412157 0.84 LPL (0.41) LPLLIPGAAK1CA1CA2
SCHEMBL20448945 0.82 CSF1R (0.42) LPLLIPGAAK1CA1CA2
SCHEMBL2408634 0.82 CSF1R (0.42) LPLLIPGCA1CA2CA9
SCHEMBL22788287 0.82 PDE4A (0.33) AAK1KCNH2GRIN1GRIN2BBACE1
SCHEMBL858457 0.81 CSF1R (0.45) LPLLIPGAAK1EGFRCA1
SCHEMBL130052 0.81 LPL (0.40) LPLLIPGAAK1CA1CA2
SCHEMBL253525 0.81 LPL (0.45) LPLLIPGAAK1EGFRCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114989164-A Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2022-09-02 CN disclosed
EP-3983075-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
EP-3983074-A1 PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
EP-3983072-A1 PYRAZINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
EP-3982958-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed