SCHEMBL4673408

SCHEMBL4673408

Cc1ccc(N(C)CC2(NC(=O)OCC(C)(C)C)CC2)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.36
TSHR P16473 5/20 0.33
FSHR P23945 5/20 0.33
KMT2A Q03164 1/20 0.33
GABRA1 P14867 3/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
POLB P06746 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
AAK1 Q2M2I8 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL27659806 0.86 DGAT1 (0.37) TSHRKMT2AGABRA1CCNE1CDK2
SCHEMBL4669413 0.76 KDM1A (0.35)
Hydrochloric Acid SCHEMBL4824103 0.75 KDM1A (0.35)
SCHEMBL4823642 0.69 IDO1 (0.34) TSHRKMT2APOLBALDH1A1IDO1
SCHEMBL4673413 0.68 KDM1A (0.30)
SCHEMBL4673405 0.67 POLB (0.31) POLB
SCHEMBL20069723 0.65 RET (0.42) RETTSHRFSHRKMT2ADPP8
SCHEMBL5302085 0.65 KDM1A (0.30)
SCHEMBL4672795 0.65 MEN1 (0.34) KMT2AALDH1A1
SCHEMBL4670343 0.65

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
EP-1757586-B1 POLYSBUSTITUIRTE 1,1-PYRIDINYLAMINOCYCLOPROPANAMIN DERIVATE, VERFAHREN ZU DEREN HERSTELLUNG UND DIESE ENTHALTENDE PHARMATUETISCHE ZUSAMMENSETZUNG SERVIER LAB (FR) 2008-12-03 EP disclosed
EP-1757586-A1 POLYSBUSTITUIRTE 1,1-PYRIDINYLAMINOCYCLOPROPANAMIN DERIVATE, VERFAHREN ZU DEREN HERSTELLUNG UND DIESE ENTHALTENDE PHARMATUETISCHE ZUSAMMENSETZUNG Les Laboratoires Servier (FR) 2007-02-28 EP disclosed
WO-2007012761-A1 NOVEL POLYSUBSTITUTED 1,1-PYRIDINYL AMINOCYCLOPROPANAMINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2007-02-01 WO disclosed