SCHEMBL8200314

SCHEMBL8200314

c1ccc(CCC2CC2)nc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.53
HRH3 Q9Y5N1 3/20 0.48
LMNA P02545 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
ALDH1A1 P00352 1/20 0.47
ALOX15 P16050 1/20 0.47
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL29706725 0.92 HPGD (0.51) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL6251738 0.91 HRH3 (0.49) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL6850513 0.91 HPGD (0.57) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL4572676 0.89 HRH1 (0.53) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL38662956 0.88 HRH1 (0.46) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL28159880 0.88 SLC6A4 (0.47) HRH1HRH3MEN1HPGDKMT2A
SCHEMBL18505947 0.83 HRH1 (0.48) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL4572675 0.82 HPGD (0.52) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL4572678 0.82 HRH1 (0.50) HRH1HRH3LMNATAAR1ALDH1A1
SCHEMBL4572677 0.80 HPGD (0.55) HRH1HRH3MEN1HPGDKMT2A

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-6043227-A C11 carbamates of macrolide antibacterials PFIZER INC. (US) 2000-03-28 US disclosed