SCHEMBL4987764

SCHEMBL4987764

Cc1nc(=O)c2cnccc2o1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ELANE P08246 5/20 0.38
LMNA P02545 2/20 0.33
F7 P08709 2/20 0.33
F3 P13726 2/20 0.33
TDO2 P48775 2/20 0.33
F10 P00742 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
IDO1 P14902 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33

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
SCHEMBL5821413 0.86 TDO2 (0.42) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL3533214 0.76 KDM4E (0.57) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL30200573 0.73 L3MBTL1 (0.44) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL4163580 0.73 L3MBTL1 (0.44) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL7600946 0.73 ELANE (0.54) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL1964870 0.71 ELANE (0.61) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL19706880 0.71 ALDH1A1 (0.50) KDM4EALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL11884986 0.71 ACHE (0.37) KDM4EALDH1A1TDO2HTTIDO1
SCHEMBL11121163 0.71 ALDH2 (0.42) KMT2AKDM4EMEN1ALDH1A1ELANE
SCHEMBL30398598 0.69 L3MBTL1 (0.41) KMT2AKDM4EMEN1ALDH1A1ELANE

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-1954283-A2 COMPOUNDS FOR MODULATING TRPV3 FUNCTION Hydra Biosciences, Inc. (US) 2008-08-13 EP disclosed
WO-2007056124-A2 COMPOUNDS FOR MODULATING TRPV3 FUNCTION HYDRA BIOSCIENCES, INC. (US) 2007-05-18 WO disclosed