SCHEMBL14167603

SCHEMBL14167603

Bc1ccc(N2CCCOCC2)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 8/20 0.53
▸ ALDH1A1 P00352 5/20 0.50
▸ HPGD P15428 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ CYP11B1 P15538 1/20 0.43
▸ CYP11B2 P19099 1/20 0.43

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
SCHEMBL17656739 0.93 ALDH1A1 (0.55) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL10281036 0.84 MAPT (0.47) CNR2ALDH1A1SMN1; SMN2KDM4ECYP1A2
SCHEMBL19341535 0.84 MAPT (0.51) CNR2ALDH1A1SMN1; SMN2CYP1A2LMNA
SCHEMBL14167598 0.81 AKR1C3 (0.63) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL2744078 0.81 CNR2 (0.53) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL13724949 0.81 ALDH1A1 (0.57) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL18307176 0.81 CNR2 (0.53) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL14642619 0.77 CYP11B1 (0.55) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL13658041 0.77 ALDH1A1 (0.50) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL14167546 0.77 CNR2 (0.53) CNR2ALDH1A1HPGDHSD17B10SMN1; SMN2

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-2718293-A1 SUBSTITUTED PYRIDOPYRAZINES AS NOVEL SYK INHIBITORS Hutchison Medipharma Limited (CN) 2014-04-16 — — EP disclosed
WO-2012167733-A1 SUBSTITUTED PYRIDOPYRAZINES AS NOVEL SYK INHIBITORS HUTCHISON MEDIPHARMA LIMITED (CN) 2012-12-13 — — WO disclosed
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