SCHEMBL9075319

SCHEMBL9075319

CCOC(=O)c1cc(NC(=N)N)cc(C(=O)Nc2ccc(OCCC3(C)CCc4c(C)c(O)c(C)c(C)c4O3)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
PPARG P37231 1/20 0.38
ALOX5 P09917 6/20 0.38
NR1I2 O75469 1/20 0.36
CYP4F2 P78329 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 2/20 0.35
GSTP1 P09211 1/20 0.35
TTPA P49638 1/20 0.35
USP2 O75604 1/20 0.35
THRB P10828 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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 SCHEMBL9074683 0.99 MAPT (0.39) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9075477 0.96 CYP4F2 (0.39) MAPTMEN1KMT2ATDP1PPARG
Hydrochloric Acid SCHEMBL9074345 0.95 CYP4F2 (0.39) MAPTMEN1KMT2ATDP1PPARG
Hydrochloric Acid SCHEMBL9074274 0.91 PPARG (0.35) MAPTMEN1KMT2APPARGALDH1A1
Hydrochloric Acid SCHEMBL9076032 0.89 MAPT (0.44) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9074824 0.88 PPARG (0.43) MAPTMEN1KMT2ATDP1PPARG
Hydrochloric Acid SCHEMBL9074342 0.88 PPARG (0.43) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9073405 0.88 CYP4F2 (0.38) MAPTMEN1KMT2AALOX5NR1I2
Hydrochloric Acid SCHEMBL9224263 0.87 CYP4F2 (0.38) MAPTMEN1KMT2AALOX5NR1I2
SCHEMBL9279355 0.86 TP53 (0.41) MAPTMEN1KMT2AALDH1A1TP53

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-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
EP-0387771-A2 Benzopyran derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1990-09-19 EP claimed