SCHEMBL4636296

SCHEMBL4636296

Cc1cc2cc(C(F)(F)F)ccn2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.42
CA2 P00918 1/20 0.38
NFE2L2 Q16236 1/20 0.38
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
KIF11 P52732 2/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
MAT2A P31153 2/20 0.33
FFAR1 O14842 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNA2 P20248 1/20 0.33

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
SCHEMBL149606 0.78 NPC1 (0.51) CA2MAPTMEN1NPC1RAB9A
SCHEMBL26423050 0.76 SMN1; SMN2 (0.40) GRM5MAPTMEN1NPC1RAB9A
SCHEMBL26262652 0.72 MAPT (0.44) CA2MAPTMEN1NPC1RAB9A
SCHEMBL15767035 0.68 GRM5 (0.44) GRM5SMN1; SMN2
SCHEMBL29893644 0.67 HTT (0.38) CA2MAT2ANOTUMALDH1A1CYP1A2
SCHEMBL7169879 0.67 MEN1 (0.36) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL25516096 0.66 PNMT (0.45)
SCHEMBL321553 0.66 ALOX15 (0.48) GRM5MAPTMEN1NPC1RAB9A
M-Xylene SCHEMBL21585133 0.66 TSHR (0.56) NFE2L2MAPTMEN1RAB9AKMT2A
SCHEMBL25514805 0.66 ALDH1A1 (0.41) MAPTMEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2008-12-11 US disclosed
CN-101305001-A Indolizine derivatives as ligands of the CRTH2 receptor ARGENTA DISCOVERY LTD (GB) 2008-11-12 CN disclosed
EP-1931663-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR Argenta Discovery Limited (GB) 2008-06-18 EP disclosed
WO-2007031747-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2007-03-22 WO 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-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor HRH4, HRH2, HRH3 GRM5 258/4885CA2 1080/4885NFE2L2 634/4885

“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.