SCHEMBL5162085

SCHEMBL5162085

O=c1[nH]nc(CNc2ccc(F)cc2F)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.64
▸ LMNA P02545 2/20 0.64
▸ MAPT P10636 4/20 0.55
▸ GAA P10253 2/20 0.55
▸ HTT P42858 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ THRB P10828 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ ENPP1 P22413 2/20 0.54
▸ AR P10275 5/20 0.52
▸ HIF1A Q16665 1/20 0.52
▸ PRMT5 O14744 1/20 0.49
▸ HDAC1 Q13547 1/20 0.48
▸ PARP1 P09874 2/20 0.47
▸ POLB P06746 1/20 0.46

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
SCHEMBL23657600 0.78 LMNA (1.00) KMT2ALMNAMAPTGAAHTT
SCHEMBL28812947 0.77 AR (0.76) LMNAHTTENPP1ARPRMT5
SCHEMBL5165966 0.76 MAPT (0.78) KMT2ALMNAMAPTGAAHTT
SCHEMBL5163931 0.74 KMT2A (0.57) KMT2ALMNAMAPTGAAHTT
SCHEMBL17444766 0.73 KDM4E (0.60) KMT2ALMNAMAPTGAAHTT
SCHEMBL5203429 0.72 SHMT2 (0.56) LMNAGAAHTTKDM4EALDH1A1
SCHEMBL7122967 0.72 AR (0.77) LMNAENPP1ARPRMT5PARP1
SCHEMBL12955362 0.71 PARP1 (0.70) LMNAENPP1ARPARP1
SCHEMBL5160111 0.71 MAPT (0.75) KMT2ALMNAMAPTGAAHTT
SCHEMBL5160240 0.71 MAPT (1.00) KMT2ALMNAMAPTGAAHTT

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
EP-1231982-B1 USE OF PHTHALAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES ABBOTT GMBH & CO KG (DE) 2007-03-21 — — EP disclosed
US-6903098-B1 Use of phthalazine derivatives ABBOTT GMBH & CO. (DE) 2005-06-07 — — US disclosed
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