SCHEMBL7918577

SCHEMBL7918577

Cc1cccc(Oc2nnc(-c3ccccc3)c3ccccc23)c1C

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 6/20 0.61
ALDH1A1 P00352 6/20 0.61
HTT P42858 5/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
LMNA P02545 3/20 0.61
MAPT P10636 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.55
KDM4E B2RXH2 2/20 0.47
HPGD P15428 1/20 0.47
GAA P10253 1/20 0.45
ESR1 P03372 1/20 0.43
TP53 P04637 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
SCHEMBL7914884 0.89 ALDH1A1 (0.66) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL27973382 0.85 NPSR1 (0.64) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL7913419 0.79 NPSR1 (0.60) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL7912332 0.78 NPSR1 (0.68) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL7914894 0.77 NPSR1 (0.57) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL27965124 0.76 KMT2A (0.79) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL7904930 0.76 NPSR1 (1.00) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL7913387 0.75 NPSR1 (0.87) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL7904990 0.74 NPSR1 (0.55) NPSR1ALDH1A1HTTMEN1KMT2A
SCHEMBL27920401 0.74 HTT (0.56) NPSR1ALDH1A1HTTMEN1KMT2A

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