SCHEMBL8957475

SCHEMBL8957475

O=C1NC(=O)C(Cc2ccc(OC3(Oc4ccc(CC5SC(=O)NC5=O)cc4)CCCCC3)cc2)S1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.68
CYP3A4 P08684 2/20 0.68
ALDH1A1 P00352 2/20 0.68
MEN1 O00255 1/20 0.68
TP53 P04637 1/20 0.68
CYP1A2 P05177 1/20 0.68
HPGD P15428 1/20 0.68
ALOX15 P16050 1/20 0.68
TSHR P16473 1/20 0.68
KMT2A Q03164 1/20 0.68
HSD17B10 Q99714 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
HRH3 Q9Y5N1 1/20 0.60
FFAR1 O14842 5/20 0.56
PPARA Q07869 2/20 0.56
PPARG P37231 11/20 0.53
RXRA P19793 1/20 0.48
MPC2 O95563 2/20 0.47
CYP2C8 P10632 2/20 0.47
CYP2C9 P11712 2/20 0.47

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
Ciglitazone SCHEMBL20125576 0.81 HPGD (1.00) MAPTCYP3A4ALDH1A1MEN1TP53
Ciglitazone SCHEMBL38185 0.81 HPGD (1.00) MAPTCYP3A4ALDH1A1MEN1TP53
Ciglitazone SCHEMBL20125581 0.81 HPGD (1.00) MAPTCYP3A4ALDH1A1MEN1TP53
SCHEMBL8312939 0.81 MAPT (0.69) MAPTCYP3A4ALDH1A1MEN1TP53
SCHEMBL9570559 0.81 MAPT (0.83) MAPTCYP3A4ALDH1A1MEN1TP53
Ciglitazone SCHEMBL3189397 0.80 HPGD (0.98) MAPTCYP3A4ALDH1A1MEN1TP53
Ciglitazone SCHEMBL21582134 0.80 HPGD (0.98) MAPTCYP3A4ALDH1A1MEN1TP53
SCHEMBL5577116 0.79 CYP3A4 (0.72) MAPTCYP3A4ALDH1A1MEN1TP53
SCHEMBL12521809 0.79 CYP3A4 (0.76) MAPTCYP3A4ALDH1A1MEN1TP53
SCHEMBL3840336 0.79 FFAR1 (0.65) MAPTCYP3A4ALDH1A1MEN1TP53

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-5508296-A HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1996-04-16 US claimed