SCHEMBL9604430

SCHEMBL9604430

C=CCN(CC=C)CC(=C)O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
Hydrochloric Acid SCHEMBL11444043 0.97 OPRM1 (0.32) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL10368806 0.94 KDM4E (0.32) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL15955451 0.84 KDM4E (0.31) MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL504039 0.80 MEN1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL2058525 0.79
SCHEMBL175747 0.76 TDP1 (0.50) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL609861 0.76 MEN1 (0.31) MEN1KMT2AALDH1A1
SCHEMBL11465670 0.76
SCHEMBL2820192 0.76 CYP1A2 (0.46) MEN1KMT2AALDH1A1
SCHEMBL327211 0.75 ALOX15 (0.45) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1

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
US-5198557-A PROCESS FOR THE RESOLUTION OF 3-(4-SUBSTITUTED-PHENYL)-GLYCIDIC ACID DERIVATIVES ZAMBON GROUP S.P.A. (IT) 1993-03-30 US claimed
US-5198557-A PROCESS FOR THE RESOLUTION OF 3-(4-SUBSTITUTED-PHENYL)-GLYCIDIC ACID DERIVATIVES ZAMBON GROUP S.P.A. (IT) 1993-03-30 US disclosed