SCHEMBL642357

SCHEMBL642357

Cn1ccc(NC(=O)c2cc(OCc3ccccc3)c3c(c2)OC(C=O)C3)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.43
GCK P35557 7/20 0.42
GABRA5 P31644 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NOTUM Q6P988 1/20 0.38
LRRK2 Q5S007 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGDS O60760 1/20 0.37

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
SCHEMBL643238 0.87 PTGER1 (0.42) PTGER1GCKGABRA5NPC1RAB9A
SCHEMBL642736 0.87 GCK (0.45) PTGER1GCKGABRA5NPC1RAB9A
SCHEMBL644550 0.86 PTGER1 (0.43) PTGER1GCKGABRA5NPC1RAB9A
SCHEMBL15780548 0.84 NPC1 (0.41) GCKGABRA5NPC1RAB9ASMN1; SMN2
SCHEMBL2644123 0.81 MEN1 (0.45) PTGER1NPC1RAB9ASMN1; SMN2
SCHEMBL642856 0.80 GCK (0.58) PTGER1GCKGABRA5NPC1RAB9A
SCHEMBL642454 0.77 GCK (0.43) GCKNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL643885 0.76 GCK (0.47) GCK
SCHEMBL9923510 0.76 PTGER1 (0.45) PTGER1GCKGABRA5NPC1RAB9A
SCHEMBL1426983 0.75 GCK (0.61) PTGER1GCKNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119624-B2 Fused phenyl amido heterocyclic compounds PFIZER INC. (US) 2012-02-21 US disclosed
US-8119624-B2 Fused phenyl amido heterocyclic compounds PFIZER INC. (US) 2012-02-21 US disclosed
US-8119624-B2 Fused phenyl amido heterocyclic compounds PFIZER INC. (US) 2012-02-21 US disclosed
US-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds PFIZER INC 2011-02-17 US disclosed
US-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds PFIZER INC 2011-02-17 US disclosed
US-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds PFIZER INC 2011-02-17 US disclosed
US-7842713-B2 Fused phenyl amido heterocyclic compounds PFIZER INC (US) 2010-11-30 US disclosed
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
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 (2 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-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds GCK, GCKR, HK1 PTGER1 1908/4885GCK 1/4885GABRA5 3564/4885
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS GCK, GCKR, HK1 PTGER1 1908/4885GCK 1/4885GABRA5 3564/4885

“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.