SCHEMBL6846932

SCHEMBL6846932

c1ccc(NC2(Nc3ccccc3)CC3CCC2C3)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 4/20 0.43
P2RX7 Q99572 5/20 0.35
EPHX2 P34913 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
NR5A2 O00482 3/20 0.34
NR5A1 Q13285 2/20 0.34
HSD11B1 P28845 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
FAAH O00519 1/20 0.30

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
SCHEMBL25384466 0.69 ALOX5AP (0.36) ALOX5APP2RX7EPHX2HSD11B1ALDH1A1
SCHEMBL790990 0.68 ALOX5AP (0.67) ALOX5APHSD11B1
SCHEMBL25383720 0.67 L3MBTL1 (0.47) ALOX5APP2RX7EPHX2L3MBTL1MAPT
SCHEMBL26667147 0.67 NR5A2 (0.41) L3MBTL1NR5A2NR5A1DDB1CRBN
SCHEMBL138594 0.67 EPHX2 (0.56) P2RX7EPHX2ALDH1A1MAPTFAAH
Hydrochloric Acid SCHEMBL27845477 0.66 EPHX2 (0.54) P2RX7EPHX2ALDH1A1MAPTFAAH
SCHEMBL3582800 0.66 ALOX5AP (0.51) ALOX5APHSD11B1MAPT
SCHEMBL11028108 0.66 ALOX5AP (0.48) ALOX5AP
SCHEMBL25383742 0.65 EPHX2 (0.46) P2RX7EPHX2L3MBTL1ALDH1A1MAPT
SCHEMBL28205291 0.64 EPHX2 (0.49) P2RX7EPHX2FAAH

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-6777111-B1 HEAT ENDURANCE; LOW CRYSTALLINITY; EMPLOYING CONDENSED RING DERIVATIVE KABUSHIKI KAISHA CHUO KENKYUSHO (JP) 2004-08-17 US disclosed
US-6761747-B2 Dispersion containing pyrogenically manufactured abrasive particles with superparamagnetic domains DEGUSSA AG (DE) 2004-07-13 US disclosed