SCHEMBL25365239

SCHEMBL25365239

O=C(O)CN1Cc2cc(Oc3ccccc3)ccc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 15/20 0.56
ITGA2B P08514 14/20 0.56
TDP1 Q9NUW8 1/20 0.51
LPAR3 Q9UBY5 2/20 0.49
LPAR1 Q92633 1/20 0.49
ITGAV P06756 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
SIRT1 Q96EB6 1/20 0.47
KMT2A Q03164 1/20 0.44

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
SCHEMBL30530761 1.00 ITGB3 (0.56) ITGB3ITGA2BTDP1LPAR3LPAR1
SCHEMBL25363677 0.90 TDP1 (0.51) ITGB3ITGA2BTDP1LPAR3LPAR1
SCHEMBL30530754 0.87 ITGB3 (0.66) ITGB3ITGA2B
SCHEMBL25365464 0.87 ITGB3 (0.66) ITGB3ITGA2B
SCHEMBL25365852 0.85 ITGB3 (0.45) ITGB3ITGA2BTDP1LPAR3LPAR1
SCHEMBL311850 0.78 KDM4E (0.71) TDP1KDM4EALOX15TSHRSIRT1
SCHEMBL29676908 0.78 KDM4E (0.71) TDP1KDM4EALOX15TSHRSIRT1
SCHEMBL25364471 0.77 GHSR (0.39) ITGB3ITGA2BLPAR3LPAR1ITGAV
SCHEMBL15939257 0.76 ITGB3 (0.50) ITGB3ITGA2BKDM4EALOX15TSHR
SCHEMBL30530774 0.76 ITGB3 (0.41) ITGB3ITGA2BLPAR3LPAR1ITGAV

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
EP-4216946-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Achillion Pharmaceuticals, Inc. (US) 2023-08-02 EP disclosed
WO-2022066774-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2022-03-31 WO disclosed