SCHEMBL7762018

SCHEMBL7762018

[CH2]c1ccccc1/C=N/C(C)C

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7521680 0.79 NPC1 (0.44) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL8854072 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL8854070 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL19297044 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL10336703 0.75 ALDH1A1 (0.54) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL21055888 0.75 ALDH1A1 (0.54) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL2493458 0.75 ALDH1A1 (0.54) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL8265079 0.75 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTUSP2POLB
SCHEMBL6862696 0.72 GRIN2D (0.53) ALDH1A1KDM4EMAPTGAAHPGD
SCHEMBL10936109 0.71 ADRA1D (0.38) ALDH1A1KDM4EMAPTGAAHPGD

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-1101492-A1 NOVEL REMEDIES FOR ALLERGIC DISEASES FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2001-05-23 EP disclosed