SCHEMBL20140769

SCHEMBL20140769

CCc1c(C(=O)O)n(CCN)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.48
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
POLB P06746 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
FABP3 P05413 1/20 0.43
FABP4 P15090 1/20 0.43
FABP5 Q01469 1/20 0.43

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
SCHEMBL28280817 0.86 KDM4E (0.59) FOLH1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL10383765 0.81 FOLH1 (0.71) FOLH1KDM4EMEN1KMT2APOLB
SCHEMBL2272671 0.80 MEN1 (0.62) KDM4ESMN1; SMN2MEN1KMT2APOLB
SCHEMBL20139846 0.79 FOLH1 (0.47) FOLH1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL14119038 0.77 MEN1 (0.46) FOLH1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL28665614 0.77 MEN1 (0.44) FOLH1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL28660724 0.76 MEN1 (0.45) FOLH1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL5669208 0.75 CNR2 (0.54) FOLH1KDM4EALDH1A1HPGD
SCHEMBL28662112 0.74 MEN1 (0.43) FOLH1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL28660747 0.72 MEN1 (0.43) FOLH1KDM4ESMN1; SMN2MEN1KMT2A

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-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed