SCHEMBL5500648

SCHEMBL5500648

CN1CCCC1CCN1CCN(C2CCN(Cc3ccccc3)CC2)C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
RECQL P46063 1/20 0.49
TSHR P16473 1/20 0.46
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
ACHE P22303 2/20 0.45
MC4R P32245 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 1/20 0.43
CHRM4 P08173 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
SCHEMBL5505504 0.79 SMN1; SMN2 (0.49) SMN1; SMN2RECQLTSHRDRD2DRD4
SCHEMBL5504701 0.79 SMN1; SMN2 (0.49) SMN1; SMN2RECQLTSHRDRD2DRD4
SCHEMBL5500621 0.77 HRH3 (0.48) SMN1; SMN2RECQLTSHRDRD2DRD4
SCHEMBL5500642 0.77 DRD2 (0.43) SMN1; SMN2RECQLDRD2DRD4DRD3
SCHEMBL3393340 0.77 MC4R (0.56) DRD2DRD4DRD3ACHEMC4R
SCHEMBL8176219 0.77 MC4R (0.56) DRD2DRD4DRD3ACHEMC4R
SCHEMBL3393342 0.77 MC4R (0.56) DRD2DRD4DRD3ACHEMC4R
SCHEMBL3709310 0.76 RECQL (0.70) SMN1; SMN2RECQLTSHRDRD2DRD4
SCHEMBL5505487 0.75 CYP1A2 (0.45) ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL3706762 0.75 RECQL (0.68) SMN1; SMN2RECQLTSHRDRD2DRD4

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-1847530-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 EP disclosed