SCHEMBL8026360

SCHEMBL8026360

N#Cc1ccc(Cc2cc3ccccc3o2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
LOXL2 Q9Y4K0 2/20 0.49
CYP2A6 P11509 1/20 0.49
AGXT P21549 1/20 0.45
HTR1A P08908 2/20 0.42
HTR2B P41595 2/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
CYP19A1 P11511 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
SLC5A2 P31639 1/20 0.41
HRH3 Q9Y5N1 5/20 0.40
DRD2 P14416 1/20 0.40
PGR P06401 2/20 0.40
CCR2 P41597 1/20 0.40

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
SCHEMBL9573693 0.81 PGR (0.44) MAPTCYP2A6HRH3PGR
SCHEMBL7806512 0.81 LOXL2 (0.60) LOXL2CYP2A6AGXTHTR1AHTR2B
SCHEMBL11107879 0.80 LOXL2 (0.55) MAPTLOXL2AGXTHTR1AHTR2B
SCHEMBL22113436 0.79 HTR2B (0.73) HTR1AHTR2BDRD2
SCHEMBL11612003 0.79 LOXL2 (0.53) MAPTLOXL2AGXTHTR1AHTR2B
SCHEMBL10368738 0.79 LOXL2 (0.53) MAPTLOXL2AGXTHTR1AHTR2B
SCHEMBL11616186 0.79 LOXL2 (0.53) MAPTLOXL2CYP2A6AGXTHTR1A
SCHEMBL29087527 0.79 LOXL2 (0.53) LOXL2CYP2A6AGXTHTR1AHTR2B
SCHEMBL7389419 0.78 HRH3 (0.44) MAPTCYP2A6HRH3
SCHEMBL14075637 0.77 LOXL2 (0.69) LOXL2CYP2A6AGXTHTR1AHTR2B

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-6114532-A ANTICOAGULANT BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-09-05 US disclosed