SCHEMBL8898801

SCHEMBL8898801

COC(=O)c1ccc(C(=O)O)c(N(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TSHR P16473 2/20 0.47
ALDH1A1 P00352 9/20 0.46
KDM4E B2RXH2 6/20 0.46
MAPT P10636 4/20 0.46
HPGD P15428 3/20 0.46
GLA P06280 3/20 0.46
GAA P10253 3/20 0.46
ATM Q13315 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
THRB P10828 1/20 0.45
HTT P42858 1/20 0.45
LMNA P02545 4/20 0.44
RAB9A P51151 3/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL8900113 0.93 KDM4E (0.51) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL14340699 0.90 KMT2A (0.49) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL2470451 0.84 KDM4E (0.51) TSHRALDH1A1KDM4EHSD17B10LMNA
SCHEMBL6935168 0.81 TSHR (0.47) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL17659280 0.79 PLA2G2A (0.47) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL4408743 0.77 TSHR (0.67) MEN1KMT2ATSHRALDH1A1MAPT
SCHEMBL9310532 0.77 TSHR (0.50) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL10400378 0.76 KDM4E (0.59) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL7811751 0.75 NPSR1 (0.48) KMT2ATSHRALDH1A1KDM4EMAPT
SCHEMBL644612 0.74 MAPT (0.60) KMT2ATSHRALDH1A1KDM4EMAPT

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-5616779-A Process for the preparation of 2,5-di-phenylamino-terephthalic acid and its dialkyl esters HOECHST AG (DE) 1997-04-01 US disclosed