SCHEMBL7912157

SCHEMBL7912157

Clc1ccc(Cl)c(Oc2nnc(-c3ccccc3)c3ccccc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.55
NPSR1 Q6W5P4 5/20 0.55
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
HTT P42858 4/20 0.55
MAPT P10636 4/20 0.55
ALDH1A1 P00352 4/20 0.55
SMN1; SMN2 Q16637 5/20 0.49
CYP1A2 P05177 3/20 0.45
CYP2C9 P11712 3/20 0.45
CYP2C19 P33261 3/20 0.45
CYP3A4 P08684 2/20 0.45
KDM4E B2RXH2 1/20 0.45
PDE5A O76074 1/20 0.45
CYP2D6 P10635 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
PDE1A P54750 1/20 0.45
PDE1B Q01064 1/20 0.45
PDE3B Q13370 1/20 0.45

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
SCHEMBL7913419 0.85 NPSR1 (0.60) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7913323 0.80 KMT2A (0.73) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7904890 0.79 NPSR1 (0.61) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7912155 0.77 NPSR1 (0.56) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7904990 0.75 NPSR1 (0.55) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7914884 0.75 ALDH1A1 (0.66) LMNANPSR1MEN1KMT2AHTT
SCHEMBL27965124 0.74 KMT2A (0.79) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7912332 0.73 NPSR1 (0.68) LMNANPSR1MEN1KMT2AHTT
SCHEMBL27956430 0.72 ALDH1A1 (0.69) LMNANPSR1MEN1KMT2AHTT
SCHEMBL7918577 0.71 NPSR1 (0.61) LMNANPSR1MEN1KMT2AHTT

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