SCHEMBL7845040

SCHEMBL7845040

C=CCc1cc2c(c(CC=C)c1O)CCC(=O)N2c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ GAA P10253 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HPGD P15428 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRB2 P47870 1/20 0.32

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
SCHEMBL7854247 0.86 POLB (0.47) KMT2AMEN1GAALMNACYP3A4
SCHEMBL9052805 0.82 GAA (0.35) KMT2AMEN1GAANPSR1KDM4E
SCHEMBL7856800 0.82 KMT2A (0.40) KMT2AMEN1GAANPSR1HPGD
SCHEMBL8660070 0.80 KDM4E (0.34) KMT2AMEN1GAAHPGDKDM4E
SCHEMBL8660073 0.79 KDM4E (0.36) KMT2AMEN1GAAHPGDKDM4E
SCHEMBL8656765 0.79 GAA (0.31) KMT2AMEN1GAAKDM4EALDH1A1
SCHEMBL7852043 0.78 MEN1 (0.35) KMT2AMEN1GAAHPGDKDM4E
SCHEMBL7855653 0.78 POLB (0.36) KMT2AMEN1LMNACYP3A4CYP2D6
SCHEMBL7855481 0.77 MEN1 (0.34) KMT2AMEN1GAAKDM4EHTT
SCHEMBL7855486 0.77 MEN1 (0.34) KMT2AMEN1GAAKDM4EHTT

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
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 — — EP claimed
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