SCHEMBL14899877

SCHEMBL14899877

O=CCCC1Nc2ccccc2N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ CREBBP Q92793 5/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ BRD4 O60885 4/20 0.33

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
SCHEMBL16510220 0.71 MAPT (0.41) MAPTMEN1KMT2AALOX15GAA
SCHEMBL16864517 0.68 JAK2 (0.38) MAPTMEN1KMT2AALOX15GAA
SCHEMBL14846473 0.68 EGFR (0.33) MAPTMEN1KMT2AALOX15GAA
SCHEMBL14567926 0.68 MEN1 (0.45) MEN1KMT2AGAACREBBPALDH1A1
SCHEMBL2638823 0.67 CCKBR (0.40) IDO1
SCHEMBL13892507 0.67 MEN1 (0.37) MAPTMEN1KMT2AALOX15GAA
SCHEMBL28923189 0.67 HTR2A (0.48) KMT2AKDM4ETP53HSD17B10LMNA
SCHEMBL1600166 0.66 CREBBP (0.40) MAPTMEN1KMT2AALOX15GAA
SCHEMBL24289281 0.66 MEN1 (0.39) MAPTMEN1KMT2AALOX15GAA
SCHEMBL12379793 0.66 HTR2A (0.41) MAPTMEN1KMT2AALOX15GAA

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
EP-2586778-A2 Pyridazinone derivatives useful as glucan synthase inhibitors Merck Sharp & Dohme Corp. (US) 2013-05-01 — — EP disclosed
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