SCHEMBL2928518

SCHEMBL2928518

CN1CCN(Cc2ccc(I)c(O)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
ALDH1A1 P00352 2/20 0.50
MC4R P32245 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
CHKA P35790 5/20 0.49
HDAC6 Q9UBN7 1/20 0.47
CA2 P00918 1/20 0.46
NCF1 P14598 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
HDAC1 Q13547 1/20 0.44
KDR P35968 1/20 0.44
CHEK1 O14757 1/20 0.44

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
SCHEMBL12658239 0.85 LMNA (0.56) LMNAALDH1A1MC4RKDM4EMAPT
SCHEMBL2927003 0.82 LMNA (0.53) LMNAALDH1A1MC4RKDM4EMAPT
SCHEMBL1394191 0.79 LMNA (0.53) LMNAALDH1A1MC4RKDM4EMAPT
SCHEMBL2934367 0.79 LMNA (0.53) LMNAALDH1A1MC4RKDM4EMAPT
SCHEMBL2930022 0.78 KDM4E (0.49) LMNAALDH1A1MC4RKDM4ECHKA
SCHEMBL15495062 0.77 CHKA (0.58) LMNAALDH1A1MC4RKDM4EMAPT
SCHEMBL2477654 0.75 LMNA (0.67) LMNAALDH1A1MC4RKDM4EMAPT
SCHEMBL4427871 0.75 LMNA (0.67) LMNAALDH1A1MC4RKDM4ECHKA
SCHEMBL9996727 0.75 KDM4E (0.64) LMNAALDH1A1KDM4EMAPT
SCHEMBL2933199 0.75 CRHBP (0.50) LMNAALDH1A1MC4RKDM4ECHKA

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
EP-2229377-A1 5-ALKYL/ALKENYL-3-CYANOPYRIDINES AS KINASE INHIBITORS Wyeth LLC (US) 2010-09-22 EP disclosed
WO-2009076602-A1 5-ALKYL/ALKENYL-3-CYANOPYRIDINES AS KINASE INHIBITORS WYETH (US) 2009-06-18 WO disclosed