SCHEMBL7913320

SCHEMBL7913320

Fc1cccc(Oc2nnc(-c3ccccc3)c3ccccc23)c1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 5/20 0.61
HTT P42858 4/20 0.61
LMNA P02545 3/20 0.61
ALDH1A1 P00352 4/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPT P10636 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.54
ADORA2A P29274 3/20 0.44
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
DHODH Q02127 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40

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
SCHEMBL27965124 0.85 KMT2A (0.79) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7915167 0.84 HTT (0.73) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7913387 0.83 NPSR1 (0.87) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7914915 0.83 HTT (0.61) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7904890 0.83 NPSR1 (0.61) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7914758 0.83 NPSR1 (0.61) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7915135 0.83 NPSR1 (0.65) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL7904990 0.79 NPSR1 (0.55) NPSR1HTTLMNAALDH1A1MEN1
SCHEMBL2325857 0.78 ADORA2A (0.74) ALDH1A1MAPTADORA2AKDM4EHPGD
SCHEMBL7904969 0.78 HTT (0.58) NPSR1HTTLMNAALDH1A1MEN1

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-6207666-B1 TREATING PRECANCEROUS LESIONS BY ADMINISTERING 4-PHENYLPHTHALAZINE DERIVATIVE CELL PATHWAYS, INC. 2001-03-27 US disclosed