SCHEMBL22155017

SCHEMBL22155017

Nc1cc(NC(=O)Nc2ccnc(Cl)c2)ccc1Br

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 9/20 0.62
SMARCA4 P51532 8/20 0.62
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
NPC1 O15118 2/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CNR1 P21554 1/20 0.44
S1PR2 O95136 1/20 0.42
EPHX1 P07099 1/20 0.41
EPHX2 P34913 1/20 0.41
BLM P54132 1/20 0.41
MALT1 Q9UDY8 1/20 0.40
RAB9A P51151 1/20 0.40
JAK2 O60674 1/20 0.40
TYK2 P29597 1/20 0.40

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
SCHEMBL22155091 0.84 SMARCA2 (0.64) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL22154752 0.83 SMARCA2 (0.68) SMARCA2SMARCA4MEN1KMT2ANPC1
SCHEMBL9599834 0.83 SMARCA2 (0.86) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL22155312 0.83 SMARCA2 (0.66) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL22125317 0.80 GRM4 (0.60) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL22125514 0.80 SMARCA2 (0.66) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL22125257 0.80 GRM4 (0.60) SMARCA2SMARCA4MEN1KMT2AMAPT
SCHEMBL29555847 0.80 SMARCA2 (0.69) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL11047103 0.79 SMARCA2 (0.79) SMARCA2SMARCA4MEN1KMT2ALMNA
SCHEMBL22154751 0.79 SMARCA2 (0.64) SMARCA2SMARCA4

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-2020126968-A2 UREA DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-06-25 WO disclosed