SCHEMBL10079264

SCHEMBL10079264

NCc1cc(Cl)cc(CNC2CCNCC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
KDM1A O60341 1/20 0.35
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
BTK Q06187 1/20 0.34
SOS1 Q07889 1/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
EP300 Q09472 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
CXCR4 P61073 2/20 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
SCHEMBL10079262 0.82 POLB (0.41) POLBALDH1A1TSHRKDM1ACARM1
SCHEMBL5760854 0.80 KCNH2 (0.46) POLBALDH1A1TSHRKDM1ACARM1
SCHEMBL10080359 0.79 PRMT5 (0.58) PRMT5WDR77EP300CHRM1CHRM3
SCHEMBL1586716 0.79 HRH3 (0.49) POLBMEN1KMT2ASOS1BCHE
SCHEMBL4586847 0.77 CARM1 (0.56) POLBALDH1A1CARM1PRMT6PRMT5
SCHEMBL3359770 0.76 POLB (0.69) POLBKDM1APRMT5WDR77MEN1
SCHEMBL20804080 0.75 ACHE (0.49) CARM1PRMT6MEN1KMT2ABCHE
SCHEMBL3818596 0.72 CCNT1 (0.41) POLBALDH1A1TSHRCARM1PRMT6
SCHEMBL4980744 0.72 PRMT5 (0.64) POLBPRMT5WDR77HRH3PIM1
SCHEMBL26268982 0.72 POLB (0.62) POLBALDH1A1TSHRKDM1AMEN1

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-2012020220-A1 COMPOUNDS NOVACTA BIOSYSTEMS LIMITED (GB) 2012-02-16 WO disclosed