SCHEMBL10570468

SCHEMBL10570468

O=C1CCc2c(OCCCN3CCN(c4ccccc4)CC3)ccc(Br)c2N1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 3/20 0.52
▸ HTR1A P08908 7/20 0.49
▸ DRD3 P35462 4/20 0.49
▸ SIGMAR1 Q99720 3/20 0.49
▸ HTR2A P28223 2/20 0.49
▸ HRH1 P35367 2/20 0.49
▸ TMEM97 Q5BJF2 2/20 0.49
▸ HRH3 Q9Y5N1 1/20 0.48
▸ KCNH2 Q12809 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
SCHEMBL10667225 0.85 DRD2 (0.49) DRD2HTR1ADRD3SIGMAR1HTR2A
SCHEMBL11073566 0.82 MAOA (0.54) DRD2DRD3SIGMAR1TMEM97HRH3
SCHEMBL10570148 0.82 DRD2 (0.59) DRD2HTR1ADRD3SIGMAR1HTR2A
SCHEMBL10571520 0.82 EPHX2 (0.42) DRD3HRH3
Hydrochloric Acid SCHEMBL10569951 0.81 DRD2 (0.58) DRD2HTR1ADRD3SIGMAR1HTR2A
Hydrochloric Acid SCHEMBL10569016 0.81 DRD2 (0.58) DRD2HTR1ADRD3SIGMAR1HTR2A
SCHEMBL10572030 0.80 HTR1A (0.51) DRD2HTR1ADRD3SIGMAR1HTR2A
SCHEMBL10570868 0.79 DRD2 (0.56) DRD2HTR1ADRD3SIGMAR1HTR2A
SCHEMBL10668197 0.79 DRD2 (0.66) DRD2HTR1ADRD3HTR2A
SCHEMBL10570129 0.77 DRD2 (0.55) DRD2HTR1ADRD3HRH3

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
US-4824840-A ANTIHISTAMINES, NERVOUS SYSTEM CONTROLLERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-04-25 — — US disclosed
US-4734416-A ANTIHISTAMINES, CENTRAL NERVOUS SYSTEM CONTROLLING ACTION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-03-29 — — US disclosed
Send feedback