SCHEMBL7967299

SCHEMBL7967299

CC(COc1ccc2c3c([nH]c2c1)CCCC3)Nc1ccccc1CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.38
LMNA P02545 8/20 0.38
ALDH1A1 P00352 6/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
KDM4E B2RXH2 5/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HPGD P15428 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX12 P18054 2/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 6/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
HTR7 P34969 1/20 0.36

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
SCHEMBL6914181 0.84 KIF11 (0.41) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7977146 0.83 TP53 (0.38) MAPTLMNAALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL7110421 0.76 KIF11 (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL7110418 0.76 KIF11 (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7967295 0.75 ADRB3 (0.40) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7979049 0.75 ADRB3 (0.40) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7981035 0.75 ADRB3 (0.40) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7977148 0.71 MAPT (0.40) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7980653 0.71 MAPT (0.40) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7980852 0.71 MAPT (0.40) MAPTLMNAALDH1A1MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172099-B1 CARBAZOLE, DIBENZOFURAN, OR DIBENZOTHIOPHENE DERIVATIVES; DIETETICS, ANTIDIABETIC AGENTS; ANTILIPEMICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-01-09 US disclosed
EP-0997458-A1 NOVEL TRICYCLIC COMPOUNDS HAVING SATURATED RINGS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-05-03 EP disclosed