SCHEMBL9310487

SCHEMBL9310487

Clc1ccc(N2CCC(NCc3ccccc3)CC2)nn1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.56
BACE1 P56817 11/20 0.56
BCHE P06276 8/20 0.56
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
GRIN2B Q13224 1/20 0.46
BPTF Q12830 1/20 0.46
FABP6 P51161 1/20 0.44

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
SCHEMBL26348201 0.78 HRH4 (0.55) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL13768899 0.76 KMT2A (0.59) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL7841536 0.75 ACHE (0.66) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL22815725 0.75 ACHE (0.70) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL26348162 0.75 MEN1 (0.58) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL7146756 0.75 VEGFA (0.63) LMNAHTTCYP1A2BPTF
SCHEMBL2002846 0.74 LMNA (0.68) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL8355347 0.72 ACHE (0.57) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL14367985 0.72 ACHE (1.00) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL26348587 0.72 ACHE (0.56) ACHEBACE1BCHEMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5292738-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-08 US disclosed
US-5157035-A Viricides JANSSEN PHARMACEUTICA N. V. (BE) 1992-10-20 US disclosed
US-5001125-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-03-19 US disclosed
EP-0156433-A2 Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1985-10-02 EP disclosed