SCHEMBL11872809

SCHEMBL11872809

CCN(CC)c1c(C)n(C)n(-c2ccccc2)c1=O

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.69
THRB P10828 2/20 0.69
LMNA P02545 2/20 0.69
CYP1A2 P05177 1/20 0.69
TSHR P16473 1/20 0.69
NAPRT Q6XQN6 1/20 0.69
HSD17B10 Q99714 2/20 0.68
BCHE P06276 8/20 0.67
PTGS1 P23219 1/20 0.59
KDM4E B2RXH2 1/20 0.58
MAPT P10636 1/20 0.58
ALOX12 P18054 1/20 0.58
PTGS2 P35354 1/20 0.55
ALDH1A1 P00352 1/20 0.55
POLB P06746 2/20 0.55
GAA P10253 1/20 0.54
ADORA3 P0DMS8 1/20 0.54

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
SCHEMBL13243351 0.86 ALOX15 (0.72) ALOX15THRBLMNACYP1A2TSHR
Aminopyrine SCHEMBL10489978 0.82 ALOX15 (1.00) ALOX15THRBLMNACYP1A2TSHR
Aminopyrine SCHEMBL26293 0.82 ALOX15 (1.00) ALOX15THRBLMNACYP1A2TSHR
Aminopyrine SCHEMBL1331641 0.82 ALOX15 (1.00) ALOX15THRBLMNACYP1A2TSHR
Aminopyrine SCHEMBL28152267 0.82 ALOX15 (0.85) ALOX15THRBLMNACYP1A2TSHR
Aminopyrine SCHEMBL2818734 0.81 ALOX15 (0.97) ALOX15THRBLMNACYP1A2TSHR
SCHEMBL24047067 0.80 BCHE (1.00) ALOX15THRBLMNACYP1A2TSHR
SCHEMBL24047028 0.79 BCHE (1.00) ALOX15THRBLMNACYP1A2TSHR
SCHEMBL24047068 0.79 BCHE (1.00) ALOX15THRBLMNACYP1A2TSHR
SCHEMBL24047189 0.79 BCHE (1.00) ALOX15THRBLMNACYP1A2TSHR

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-3933507-A LIGHT INSENSITIVE SILVER SALT, POLYMETHINE SENSITIZER AGFA-GEVAERT, A.G. (DT) 1976-01-20 US disclosed