SCHEMBL10733487

SCHEMBL10733487

OC(c1ccccc1)(c1ccccn1)C1CCNCC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.69
KMT2A Q03164 3/20 0.69
CYP2D6 P10635 2/20 0.69
LMNA P02545 1/20 0.69
HRH1 P35367 1/20 0.69
SCN1A P35498 1/20 0.69
SCN2A Q99250 1/20 0.69
SCN3A Q9NY46 1/20 0.69
NPY2R P49146 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CHRM3 P20309 3/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
HTR1A P08908 2/20 0.39

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
SCHEMBL3657243 0.91 MEN1 (0.57) MEN1KMT2ACYP2D6LMNAHRH1
SCHEMBL7436247 0.89 MEN1 (0.54) MEN1KMT2ACYP2D6LMNAHRH1
SCHEMBL16291428 0.86 MEN1 (0.56) MEN1KMT2ACYP2D6LMNAHRH1
Hydrochloric Acid SCHEMBL11680499 0.84 NPY2R (0.46) MEN1KMT2ACYP2D6LMNAHRH1
Azacyclonol SCHEMBL1648657 0.82 HRH1 (0.93) MEN1KMT2ACYP2D6LMNAHRH1
Azacyclonol SCHEMBL241817 0.82 HRH1 (1.00) MEN1KMT2ACYP2D6LMNAHRH1
Azacyclonol SCHEMBL6135637 0.81 HRH1 (0.96) MEN1KMT2ACYP2D6LMNAHRH1
Azacyclonol SCHEMBL1890138 0.81 HRH1 (0.96) MEN1KMT2ACYP2D6LMNAHRH1
SCHEMBL16291257 0.78 MEN1 (0.50) MEN1KMT2ACYP2D6LMNAHRH1
SCHEMBL10735878 0.76 KCNH2 (0.63) MEN1KMT2AHRH1NPY2RKDM4E

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
US-4680296-A ANTIALLERGENS, ANTIPRUITIC AGENTS SYNTHELABO (FR) 1987-07-14 US disclosed