SCHEMBL6869919

SCHEMBL6869919

COCCn1ccc2c(F)c(F)ccc21

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.45
HTR2A P28223 4/20 0.39
HTR2C P28335 4/20 0.39
TP53 P04637 1/20 0.36
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
GLO1 Q04760 1/20 0.34
GSK3B P49841 2/20 0.34
DYRK1A Q13627 2/20 0.34
NFATC1 O95644 1/20 0.34
P2RX7 Q99572 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 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
SCHEMBL12543751 0.81 HTR2C (0.55) GRIN2BHTR2AHTR2CTP53CNR1
SCHEMBL6872057 0.78 GRIN2B (0.42) GRIN2BHTR2AHTR2CTP53CNR1
SCHEMBL6870576 0.76 GRIN2B (0.44) GRIN2BHTR2AHTR2CTP53CNR1
SCHEMBL6871183 0.74 GRIN2B (0.45) GRIN2BHTR2AHTR2CTP53GSK3B
SCHEMBL6871093 0.74 GRIN2B (0.45) GRIN2BHTR2AHTR2CTP53CNR1
SCHEMBL31735571 0.73 GRIN2B (0.39) GRIN2BHTR2AHTR2CCNR1CNR2
SCHEMBL31735736 0.73 DYRK1A (0.37) GRIN2BHTR2AHTR2CCNR1CNR2
SCHEMBL12543380 0.72 HTR2C (0.54) GRIN2BHTR2AHTR2CCNR1CNR2
SCHEMBL31735516 0.72 HTR2C (0.38) GRIN2BHTR2AHTR2CCNR1CNR2
SCHEMBL31735638 0.72 DYRK1A (0.36) GRIN2BHTR2AHTR2CCNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2480232-B1 DISUBSTITUTED ]4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]-1H-INDOL-3-YL]-METHANONES SANOFI SA (FR) 2013-10-02 EP disclosed
EP-2480232-B1 DISUBSTITUTED ]4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]-1H-INDOL-3-YL]-METHANONES SANOFI SA (FR) 2013-10-02 EP disclosed
US-20120142735-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]- 1H-INDOL-3-YL]-METHANONES SANOFI (FR) 2012-06-07 US disclosed
US-20120142735-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]- 1H-INDOL-3-YL]-METHANONES SANOFI (FR) 2012-06-07 US disclosed
US-20120142735-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]- 1H-INDOL-3-YL]-METHANONES SANOFI (FR) 2012-06-07 US disclosed
WO-2011022449-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]-1H-INDOL-3-YL]-METHANONES SANOFI-AVENTIS (FR) 2011-02-24 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-20120142735-A1 DISUBSTITUTED [4-(5-AMINOMETHYL-PHENYL)-PIPERIDIN-1-YL]- 1H-INDOL-3-YL]-METHANONES CMA1, TPSB2, TPSAB1 GRIN2B 2828/4885HTR2A 80/4885HTR2C 37/4885

“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.