SCHEMBL7310907

SCHEMBL7310907

CCOC(=O)/C=C/CNc1cc(Cl)ccc1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
MAPT P10636 6/20 0.50
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 5/20 0.41
GAA P10253 3/20 0.41
GLA P06280 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
NFKB1 P19838 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
LMNA P02545 2/20 0.38
TTR P02766 1/20 0.38
DPP4 P27487 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
SCHEMBL7310914 1.00 ALDH1A1 (0.50) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL7311759 0.83 LMNA (0.48) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL7311755 0.83 LMNA (0.48) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL8049631 0.79 MEN1 (0.53) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL9432247 0.78 MAPT (0.41) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL9432244 0.78 MAPT (0.41) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL7300293 0.75 MEN1 (0.49) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL164410 0.74 GPR35 (0.56) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL3354607 0.72 POLB (0.49) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL3354613 0.72 POLB (0.49) ALDH1A1MAPTMEN1KMT2AHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5304560-A Treating CNS disorders; dopamine receptor antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-19 US disclosed
EP-0481342-A1 Quinazoline derivatives and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-22 EP disclosed