SCHEMBL10570868

SCHEMBL10570868

O=C1CCc2c(cccc2OCCCN2CCCN(c3ccccc3)CC2)N1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 13/20 0.56
▸ DRD3 P35462 6/20 0.53
▸ HRH3 Q9Y5N1 1/20 0.53
▸ HTR1A P08908 5/20 0.51
▸ HTR2A P28223 3/20 0.49
▸ HTR2C P28335 1/20 0.49
▸ SLC6A4 P31645 1/20 0.49
▸ HTR7 P34969 1/20 0.49
▸ HRH1 P35367 2/20 0.48
▸ TMEM97 Q5BJF2 2/20 0.48
▸ SIGMAR1 Q99720 2/20 0.48
▸ DRD4 P21917 2/20 0.47

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
SCHEMBL10570148 0.96 DRD2 (0.59) DRD2DRD3HRH3HTR1AHTR2A
Hydrochloric Acid SCHEMBL10569016 0.95 DRD2 (0.58) DRD2DRD3HRH3HTR1AHTR2A
Hydrochloric Acid SCHEMBL10569951 0.95 DRD2 (0.58) DRD2DRD3HRH3HTR1AHTR2A
SCHEMBL10570129 0.91 DRD2 (0.55) DRD2DRD3HRH3HTR1AHTR7
SCHEMBL10576246 0.87 DRD2 (0.53) DRD2DRD3HRH3HTR1AHTR2A
SCHEMBL6108202 0.86 MAOA (0.58) HRH3
SCHEMBL10568577 0.85 DRD2 (0.51) DRD2DRD3HTR1AHTR2AHTR7
SCHEMBL10428729 0.85 DRD2 (0.53) DRD2DRD3HTR1ADRD4
SCHEMBL10667225 0.84 DRD2 (0.49) DRD2DRD3HRH3HTR1AHTR2A
SCHEMBL10576436 0.83 MAOA (0.63) DRD2DRD3DRD4

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 3 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 claimed
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
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