SCHEMBL2663646

SCHEMBL2663646

CCOC(=O)c1cc(Oc2ccc(SOOC)cc2)c2cc(C=O)oc2c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 2/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
PTGS2 P35354 8/20 0.37
RXFP1 Q9HBX9 1/20 0.34
HSD17B2 P37059 1/20 0.34
GCK P35557 1/20 0.34
ICAM1 P05362 1/20 0.33
SELE P16581 1/20 0.33
AR P10275 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL10253204 0.86 PTGS2 (0.47) MAPTKDM4ENPC1HSP90AA1RAB9A
SCHEMBL2663684 0.86 PTGS2 (0.37) MAPTKDM4ENPC1RAB9AHPGD
SCHEMBL2663647 0.86 PTGS2 (0.37) MAPTKDM4EHPGDPOLBPTGS2
SCHEMBL2663645 0.85 PTGS2 (0.37) MAPTKDM4EHPGDPTGS2RXFP1
SCHEMBL2663697 0.85 PTGS2 (0.37) MAPTKDM4EHPGDPTGS2RXFP1
SCHEMBL2663649 0.83 GCK (0.39) MAPTKDM4EHPGDPTGS2GCK
SCHEMBL643528 0.82 GCK (0.48) MAPTKDM4ENPC1HSP90AA1RAB9A
SCHEMBL644966 0.82 MAPT (0.39) MAPTKDM4ENPC1HSP90AA1RAB9A
SCHEMBL2663748 0.79 ICAM1 (0.44) MAPTKDM4ENPC1RAB9AHPGD
SCHEMBL2663688 0.77 MAPT (0.37) MAPTKDM4ERAB9AHPGDTP53

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
US-7842713-B2 Fused phenyl amido heterocyclic compounds PFIZER INC (US) 2010-11-30 US disclosed
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS PFIZER INC. 2008-11-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS GCK, GCKR, HK1 MAPT 3264/4885KDM4E 1790/4885NPC1 1969/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.