SCHEMBL20009643

SCHEMBL20009643

CCc1nnc(-c2cc(C)ccc2C)cc1N1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.43
NR1I2 O75469 2/20 0.40
SMARCA2 P51531 2/20 0.40
SMARCA4 P51532 2/20 0.40
PBRM1 Q86U86 2/20 0.40
AR P10275 1/20 0.39
MAPT P10636 5/20 0.38
RAF1 P04049 1/20 0.37
KMO O15229 4/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
THRB P10828 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
TP53 P04637 1/20 0.35
TLR8 Q9NR97 1/20 0.35
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL20009709 0.72 BRAF (0.39) BRAFNR1I2SMARCA2SMARCA4PBRM1
SCHEMBL16727174 0.69 SLC18A3 (0.55) MAPTALDH1A1TSHRMCOLN3MEN1
SCHEMBL3162979 0.68 SLC18A3 (0.57) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL19051396 0.68 AR (0.78) ARMEN1KMT2ATP53TLR8
SCHEMBL20008359 0.68 CNR2 (0.42) ARMAPTALDH1A1MCOLN3MEN1
SCHEMBL15871966 0.67 MAPT (0.49) MAPTALDH1A1TSHRMCOLN3MEN1
SCHEMBL13326993 0.67 MEN1 (0.47) MAPTALDH1A1TSHRMCOLN3MEN1
SCHEMBL4885809 0.66 MAPT (0.68) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL20008248 0.66 KMO (0.37) BRAFNR1I2SMARCA2SMARCA4PBRM1
SCHEMBL20008296 0.66 SMARCA2 (0.40) BRAFNR1I2SMARCA2SMARCA4PBRM1

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
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed