SCHEMBL29636030

SCHEMBL29636030

OB(O)c1ccc(F)c(C(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 5/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA1 P00915 2/20 0.39
▸ MGLL Q99685 2/20 0.35
▸ TTR P02766 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ ORAI1 Q96D31 1/20 0.34
▸ ORAI2 Q96SN7 1/20 0.34
▸ ORAI3 Q9BRQ5 1/20 0.34
▸ TRPV6 Q9H1D0 1/20 0.34
▸ LPL P06858 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL13065321 1.00 ENPP2 (0.39) ENPP2CA2CA1MGLLTTR
SCHEMBL13065320 0.85 CA1 (0.38) ENPP2CA2CA1MGLLTTR
SCHEMBL128893 0.77 ENPP2 (0.46) ENPP2CA2CA1MGLLTTR
SCHEMBL25463182 0.75 ENPP2 (0.42) ENPP2CA2CA1MGLLTTR
SCHEMBL28490899 0.75 ENPP2 (0.44) ENPP2CA2CA1MGLLTTR
SCHEMBL22207451 0.73 ENPP2 (0.42) ENPP2CA2CA1MGLLTTR
SCHEMBL29954381 0.73 CA3 (0.52) ENPP2CA2CA1MGLLTTR
SCHEMBL309397 0.73 CA3 (0.52) ENPP2CA2CA1MGLLTTR
SCHEMBL1158717 0.72 ENPP2 (0.38) ENPP2CA2CA1MGLLTTR
SCHEMBL28736456 0.72 ENPP2 (0.34) ENPP2CA2CA1ALDH1A1

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
WO-2024222767-A1 CRYSTAL FORM OF BICYCLIC COMPOUND AND PREPARATION METHOD THEREFOR 贝达药业股份有限公司 2024-10-31 — — WO disclosed
CN-113164458-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-13 — — CN disclosed
CN-114989164-B Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2024-08-13 — — CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
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
CN-110062761-B Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2022-05-13 — — CN disclosed
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