SCHEMBL7811751

SCHEMBL7811751

O=C(O)c1cc(N(c2ccccc2)c2ccccc2)c(C(=O)O)cc1N(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.48
ALDH1A1 P00352 5/20 0.48
ALOX15 P16050 1/20 0.48
LMNA P02545 1/20 0.42
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
HMGB1 P09429 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA9 Q16790 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
CA14 Q9ULX7 1/20 0.41
POLB P06746 2/20 0.41
TSHR P16473 2/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL2470451 0.83 KDM4E (0.51) NPSR1ALDH1A1ALOX15LMNAKDM4E
SCHEMBL1227194 0.83 ALDH1A1 (0.54) NPSR1ALDH1A1ALOX15HPGDKDM4E
SCHEMBL17850895 0.82 AKR1C3 (0.48) NPSR1ALDH1A1LMNAHPGDKDM4E
SCHEMBL4191886 0.79 ALDH1A1 (0.44) NPSR1ALDH1A1ALOX15LMNAHPGD
SCHEMBL6935168 0.79 TSHR (0.47) NPSR1ALDH1A1ALOX15LMNAHPGD
SCHEMBL13587852 0.78 ALDH1A1 (0.54) NPSR1ALDH1A1ALOX15HPGDKDM4E
SCHEMBL25387790 0.76 ALDH1A1 (0.41) NPSR1ALDH1A1ALOX15HPGDKDM4E
SCHEMBL28494893 0.76 ALDH1A1 (0.46) NPSR1ALDH1A1ALOX15HPGDKDM4E
SCHEMBL15309180 0.76 ALDH1A1 (0.43) NPSR1ALDH1A1ALOX15LMNAHPGD
SCHEMBL19596110 0.75 ALDH1A1 (0.44) ALDH1A1ALOX15LMNAKDM4ESMN1; SMN2

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-6329086-B1 GOOD SOLUBILITY, EFFICIENCY AND STABILITY; EMITTING COLOR OF THE POLYMER CAN BE EASILY TUNED BY THE INCORPORATION OF DESIRED AROMATIC GROUP; POLYARYLENEVINYLENE EASTMAN KODAK COMPANY 2001-12-11 US disclosed