SCHEMBL17305949

SCHEMBL17305949

O=C1C=C/C(=N/c2ccccc2)C=C1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ MAPK1 P28482 4/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.35
▸ ALOX12 P18054 3/20 0.35
▸ THRB P10828 2/20 0.35
▸ ATM Q13315 2/20 0.35
▸ MMP2 P08253 1/20 0.34
▸ DBH P09172 1/20 0.34
▸ CYP3A4 P08684 3/20 0.33
▸ MAOA P21397 3/20 0.33
▸ MAOB P27338 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ PTPN22 Q9Y2R2 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL17305553 0.78 MEN1 (0.32) MEN1KMT2AALDH1A1NPC1
SCHEMBL9490925 0.75 ERBB2 (0.50) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL7593065 0.74 MAOA (0.50) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL755432 0.72 ALDH1A1 (0.47) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL1813567 0.71 TXNRD1 (0.47) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL7744841 0.69 CA12 (0.35) MAPTKDM4EMEN1KMT2AALDH1A1
Phenol SCHEMBL28096443 0.68 TDP1 (0.48) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL11119934 0.68 TXNRD1 (0.41) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL11273533 0.67 ALDH1A1 (0.38) MAPTKDM4EMEN1KMT2AMAPK1
Phenol SCHEMBL2748938 0.67 TXNRD1 (0.51) MAPTKDM4EMEN1KMT2AMAPK1

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-20150343413-A1 METHOD FOR DIRECT PHOTOPATTERNING OF MOLECULES ON SURFACES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-12-03 — — US disclosed
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