SCHEMBL7468263

SCHEMBL7468263

O=CN(c1ccc(F)cc1)N1CCC(Nc2ncnc3cc(N4CCNCC4)c([N+](=O)[O-])cc23)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
MAPT P10636 5/20 0.36
LMNA P02545 3/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 6/20 0.36
CYP2C19 P33261 3/20 0.36
CYP2C9 P11712 2/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.35
WDR5 P61964 1/20 0.35
KMT2A Q03164 1/20 0.35
PAK1 Q13153 1/20 0.34
HSD17B10 Q99714 4/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
JAK2 O60674 2/20 0.33
JAK3 P52333 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
SCHEMBL7464718 0.92 CYP1A2 (0.37) CNR1CNR2MAPTLMNAGAA
SCHEMBL7462111 0.90 CYP1A2 (0.40) CNR1CNR2MAPTLMNACYP1A2
SCHEMBL7471664 0.83 CNR1 (0.55) CNR1CNR2
SCHEMBL7468264 0.81 PAK1 (0.48) PAK1
SCHEMBL7459033 0.78 MAPT (0.46) MAPTLMNAGAAALDH1A1SMN1; SMN2
SCHEMBL7463150 0.76 CYP1A2 (0.41) CNR1CNR2MAPTCYP1A2CYP2C19
SCHEMBL7458931 0.76 NSD2 (0.56) CNR1CNR2MAPTLMNAHTT
SCHEMBL7470513 0.76 CNR1 (0.53) CNR1CNR2MAPTLMNAGAA
SCHEMBL7463135 0.76 CNR1 (0.53) CNR1CNR2MAPTLMNAALDH1A1
SCHEMBL7463091 0.75 USP10 (0.50) CNR1CNR2MAPTLMNAGAA

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-1229025-A1 NOVEL QUINAZOLINE DERIVATIVES Japan Energy Corporation (JP) 2002-08-07 EP disclosed