SCHEMBL4593835

SCHEMBL4593835

FC1[CH]CN(c2ncnc3c2oc2ccc(Cl)cc23)C1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 17/20 0.66
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.53
GPR55 Q9Y2T6 1/20 0.53
TSHR P16473 2/20 0.52
HSD17B10 Q99714 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
ALOX12 P18054 1/20 0.52
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL14547999 0.81 HRH4 (0.80) HRH4ALDH1A1LMNAKMT2AGPR55
SCHEMBL603184 0.81 HRH4 (0.83) HRH4ALDH1A1LMNAKMT2AGPR55
SCHEMBL605566 0.80 HRH4 (1.00) HRH4TSHRHSD17B10KDM4EMAPT
SCHEMBL603722 0.80 HRH4 (1.00) HRH4TSHRHSD17B10KDM4EMAPT
SCHEMBL4594647 0.80 HRH4 (1.00) HRH4TSHRHSD17B10KDM4EMAPT
SCHEMBL603938 0.78 HRH4 (0.75) HRH4
SCHEMBL604737 0.78 HRH4 (0.84) HRH4ALDH1A1LMNAKMT2AGPR55
SCHEMBL606841 0.78 HRH4 (1.00) HRH4
SCHEMBL4739169 0.78 HRH4 (0.69) HRH4ALDH1A1LMNAKMT2AGPR55
SCHEMBL603973 0.78 HRH4 (0.69) HRH4ALDH1A1LMNAKMT2AGPR55

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-1945646-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS Cellzome (UK) Ltd. (GB) 2008-07-23 EP disclosed
WO-2007039467-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS CELLZOME (UK) LTD. (GB) 2007-04-12 WO disclosed