SCHEMBL28819355

SCHEMBL28819355

O=CP(=O)(O)Oc1occ2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.33
ACP3 P15309 1/20 0.33
GPR84 Q9NQS5 2/20 0.32
PTK2B Q14289 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 2/20 0.31
PTPN1 P18031 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP14 P50281 1/20 0.30
CA14 Q9ULX7 1/20 0.30
ERN1 O75460 1/20 0.30

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
SCHEMBL547450 0.73 PTPN1 (0.39) L3MBTL1POLBPTPN1MEN1KMT2A
SCHEMBL6001561 0.69 ALDH1A1 (0.38) POLBPTPN1MEN1KMT2A
SCHEMBL6013736 0.67 HSD17B10 (0.33) POLBPTPN1MEN1KMT2ACA14
SCHEMBL10944396 0.67 HSD17B10 (0.37) L3MBTL1MEN1KMT2A
SCHEMBL98430 0.66 PTPN1 (0.42) L3MBTL1POLBPTPN1MEN1KMT2A
SCHEMBL29529441 0.66 ALDH1A1 (0.41) POLB
SCHEMBL28244381 0.66 ALDH1A1 (0.35)
SCHEMBL5359604 0.66 ALDH1A1 (0.31)
SCHEMBL27560293 0.66 ALDH1A1 (0.31)
SCHEMBL27626197 0.65 PTPN1 (0.41) L3MBTL1POLBPTPN1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102762549-B Phthalazinone derivative, and preparation method and pharmaceutical use thereof SHANGHAI HENGRUI PHARM CO LTD 2015-05-27 CN disclosed