SCHEMBL4752964

SCHEMBL4752964

Fc1ccc2c(c1)ncn2C1CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.51
MAPK14 Q16539 5/20 0.49
MAPK13 O15264 2/20 0.49
MAPK12 P53778 2/20 0.49
MAPK11 Q15759 2/20 0.49
LMNA P02545 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPK10 P53779 2/20 0.48
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
MAPT P10636 1/20 0.48
PKM P14618 1/20 0.48
HSD17B10 Q99714 2/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
PRKCI P41743 1/20 0.46
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
GAA P10253 1/20 0.45
RIPK2 O43353 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
SCHEMBL4753958 0.90 PRKCI (0.53) CCR3MAPK14MAPK13MAPK12MAPK11
SCHEMBL30914207 0.89 ALDH1A1 (0.53) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL22871605 0.84 ALDH1A1 (0.45) CCR3LMNAALDH1A1MAPK10KDM4E
SCHEMBL4671267 0.82 IRAK4 (0.51) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL1865660 0.82 DDB1 (0.53) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL30610095 0.82 IRAK4 (0.51) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL2850424 0.81 LMNA (0.53) MAPK14LMNAALDH1A1MAPK10USP2
Piperazine SCHEMBL28324587 0.81 IRAK4 (0.50) ALDH1A1HSD17B10PRKCIJAK2JAK1
SCHEMBL3290233 0.80 DRD2 (0.57) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL1573878 0.79 ALDH1A1 (0.44) LMNAALDH1A1MAPK10KDM4EUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008146064-A1 NEW BENZOFURAN DERIVATIVES AS SELECTIVE 5HT7 RECEPTOR INHIBITORS AND PROCESS FOR THEIR PREPARATION EGIS GYÓGYSZERGYÁR (HU) 2008-12-04 WO disclosed