SCHEMBL9075969

SCHEMBL9075969

Cc1c(C)c2c(c(C)c1O)CCC(C)(CCCCOc1ccc(CCSc3cccc(NC(=N)N)c3)cc1)O2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALOX5 P09917 6/20 0.39
PPARG P37231 1/20 0.38
CYP4F2 P78329 1/20 0.38
LMNA P02545 2/20 0.38
TTPA P49638 2/20 0.38
GSTP1 P09211 1/20 0.38
USP2 O75604 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NR1I2 O75469 2/20 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
Hydrochloric Acid SCHEMBL9073456 0.99 MAPT (0.41) MAPTMEN1KMT2ATDP1ALOX5
SCHEMBL9076432 0.96 MAPT (0.42) MAPTMEN1KMT2ATDP1ALOX5
Hydrochloric Acid SCHEMBL9075543 0.95 MAPT (0.42) MAPTMEN1KMT2ATDP1ALOX5
SCHEMBL9076253 0.91 MAPT (0.43) MAPTMEN1KMT2ATDP1ALOX5
Hydrochloric Acid SCHEMBL9075514 0.91 MAPT (0.42) MAPTMEN1KMT2ATDP1ALOX5
SCHEMBL9074329 0.90 MAPT (0.43) MAPTMEN1KMT2ATDP1ALOX5
Hydrochloric Acid SCHEMBL9075746 0.89 MAPT (0.42) MAPTMEN1KMT2ATDP1ALOX5
Hydrochloric Acid SCHEMBL9076690 0.88 MAPT (0.44) MAPTMEN1KMT2ATDP1ALOX5
SCHEMBL9073455 0.87 MAPT (0.44) MAPTMEN1KMT2ATDP1ALOX5
SCHEMBL9074690 0.86 MAPT (0.46) MAPTMEN1KMT2ATDP1ALOX5

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-5508450-A INHIBITORY EFFECT ON MAILLARD REACTION AND ANTIOXIDIZING EFFECT; TREATS OR PREVENTS DIABETIC COMPLICATIONS ONO PHARMACEUTICAL CO., LTD. (JP) 1996-04-16 US claimed