SCHEMBL6284157

SCHEMBL6284157

[NH]CCCc1ccncc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.56
LOXL2 Q9Y4K0 2/20 0.52
CYP3A4 P08684 5/20 0.48
CYP1A2 P05177 4/20 0.48
CYP2D6 P10635 4/20 0.48
CYP2C9 P11712 4/20 0.48
CYP2C19 P33261 3/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HRH3 Q9Y5N1 3/20 0.47
HRH4 Q9H3N8 2/20 0.47
NAAA Q02083 1/20 0.46
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HIF1A Q16665 1/20 0.41
NPC1 O15118 1/20 0.40
KMT2A Q03164 1/20 0.40
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALPL P05186 1/20 0.38

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
SCHEMBL6316189 0.93 HRH1 (0.59) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL317695 0.84
SCHEMBL726645 0.84 HRH1 (0.73) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL351920 0.84 HRH1 (0.65) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL31673871 0.81 HRH1 (0.62) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL28055322 0.81 HRH1 (0.62) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL4413800 0.81 HRH1 (0.77) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL2841394 0.81 HRH1 (0.77) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL725306 0.81 HRH1 (0.77) HRH1LOXL2CYP3A4CYP1A2CYP2D6
SCHEMBL151822 0.78 LOXL2 (0.68) HRH1LOXL2CYP3A4CYP1A2CYP2D6

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-6921762-B2 Substituted indolizine-like compounds and methods of use AMGEN INC. (US) 2005-07-26 US disclosed