SCHEMBL3843835

SCHEMBL3843835

Cn1c(C(=O)O)c(N)c2cncc(F)c21

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
DDO Q99489 1/20 0.31

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
SCHEMBL3853417 0.82 HAVCR2 (0.33) GPR35HCAR2KDM4EMEN1ALDH1A1
SCHEMBL24756083 0.62 GPR35 (0.45) GPR35KDM4EMEN1ALDH1A1LMNA
SCHEMBL2662567 0.62 EGFR (0.54) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL1432563 0.60 HTT (0.43) KDM4EKMT2A
SCHEMBL24808960 0.60 KDM4E (0.42) HCAR2KDM4EMEN1ALDH1A1LMNA
SCHEMBL695984 0.60 HCAR2 (0.46) HCAR2KDM4EMEN1ALDH1A1LMNA
SCHEMBL19332460 0.60 ALOX15 (0.40) GPR35KDM4EMEN1ALDH1A1LMNA
SCHEMBL8138907 0.59 TUBB4A (0.44) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL70438 0.58
SCHEMBL11277818 0.58 USP2 (0.44) GPR35KDM4EMEN1KMT2A

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-2099796-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2009-09-16 EP disclosed
WO-2008067481-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2008-06-05 WO disclosed