SCHEMBL14355759

SCHEMBL14355759

BCc1ccccc1N1CCN(C)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 1/20 0.61
▸ ADRA2C P18825 1/20 0.55
▸ DRD2 P14416 4/20 0.54
▸ DRD3 P35462 4/20 0.54
▸ DRD4 P21917 2/20 0.54
▸ HTR1A P08908 2/20 0.54
▸ HTR2A P28223 1/20 0.54
▸ HTR2C P28335 1/20 0.54
▸ EGFR P00533 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ BRD9 Q9H8M2 4/20 0.45
▸ BRPF1 P55201 3/20 0.45
▸ BRD4 O60885 2/20 0.45
▸ BRD7 Q9NPI1 1/20 0.45
▸ HRH2 P25021 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.43
▸ HTR6 P50406 1/20 0.42

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
SCHEMBL8361520 0.85 DRD2 (0.72) NCF1ADRA2CDRD2DRD3DRD4
SCHEMBL110927 0.81 NCF1 (0.87) NCF1ADRA2CDRD2DRD3DRD4
SCHEMBL5161795 0.81 NCF1 (0.61) NCF1ADRA2CDRD2DRD3DRD4
SCHEMBL12368809 0.81 NCF1 (0.61) NCF1ADRA2CDRD2DRD3DRD4
SCHEMBL29505669 0.81 NCF1 (0.87) NCF1ADRA2CDRD2DRD3DRD4
Hydrochloric Acid SCHEMBL10711290 0.80 NCF1 (0.59) NCF1ADRA2CDRD2DRD3DRD4
Hydrochloric Acid SCHEMBL10713089 0.80 NCF1 (0.59) NCF1ADRA2CDRD2DRD3DRD4
SCHEMBL13061367 0.80 NCF1 (0.59) NCF1ADRA2CDRD2DRD3DRD4
Hydrochloric Acid SCHEMBL10712248 0.80 NCF1 (0.59) NCF1ADRA2CDRD2DRD3DRD4
Sifaprazine SCHEMBL21524898 0.79 NCF1 (0.58) NCF1ADRA2CDRD2DRD3DRD4

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-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 — — US disclosed
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