SCHEMBL7984263

SCHEMBL7984263

O=c1[nH]c2cc(O)c(O)cc2c2ccc(O)c(O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 7/20 1.00
PRKACA P17612 4/20 1.00
PRKACG P22612 4/20 1.00
PRKACB P22694 4/20 1.00
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
PKLR P30613 1/20 0.40
GALNT2 Q10471 1/20 0.40
GALNT1 Q10472 1/20 0.40
GALNT3 Q14435 1/20 0.40
GALNT10 Q86SR1 1/20 0.40
GALNT13 Q8IUC8 1/20 0.40
GALNT6 Q8NCL4 1/20 0.40
GALNT14 Q96FL9 1/20 0.40
GLI1 P08151 1/20 0.39

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
SCHEMBL7987496 0.75 SRC (1.00) SRCPRKACAPRKACGPRKACBDAO
SCHEMBL7980308 0.74 SRC (1.00) SRCPRKACAPRKACGPRKACBPKLR
SCHEMBL7984052 0.73 SRC (0.71) SRCPRKACAPRKACGPRKACBGLI1
SCHEMBL1205187 0.72 SRC (0.56) SRCPRKACAPRKACGPRKACBPKLR
SCHEMBL29919698 0.71 SRC (0.53) SRCPRKACAPRKACGPRKACBPKLR
SCHEMBL20540115 0.71 SRC (0.53) SRCPRKACAPRKACGPRKACBPKLR
SCHEMBL3883791 0.70 SRC (1.00) SRCPRKACAPRKACGPRKACBGLI1
Water SCHEMBL28410001 0.69 SRC (0.52) SRCPRKACAPRKACGPRKACBPKLR
SCHEMBL9781435 0.68 ESR2 (0.56) SRCPRKACAPRKACGPRKACBPKLR
SCHEMBL2547457 0.68 SRC (0.58) SRCPRKACAPRKACGPRKACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed