SCHEMBL14448680

SCHEMBL14448680

CCOC(=O)C(C#N)=C1C=C(C)N(CCN2CCCCC2)C(C)=C1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.51
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ KDM4E B2RXH2 6/20 0.41
▸ HPGD P15428 4/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MAPT P10636 5/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ RECQL P46063 1/20 0.40
▸ PLK1 P53350 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
SCHEMBL14448684 0.76 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL14448681 0.76 MAPT (0.42) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL14448682 0.76 MAPT (0.42) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL14448683 0.75 MEN1 (0.41) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL13223784 0.74 MAPT (0.43) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL14448679 0.74 MAPT (0.44) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL13223786 0.73 MAPT (0.47) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL14448217 0.72 MAPT (0.51) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL12658475 0.72 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL14289478 0.71 L3MBTL1 (0.50) ALDH1A1MEN1KMT2AKDM4EHPGD

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-20070184386-A1 Optical recording material and optical recording medium MITSUBISHI CHEMICAL CORPORATION (JP) 2007-08-09 — — US disclosed
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