SCHEMBL28564684

SCHEMBL28564684

CC1CCCCCCN(C(=O)c2c(C(N)=O)ccc3ccccc23)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HPGD P15428 2/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
ACACB O00763 1/20 0.43
ACACA Q13085 1/20 0.43
RECQL P46063 1/20 0.43
MAPT P10636 2/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
TP53 P04637 2/20 0.41
GAA P10253 1/20 0.41
KDM4E B2RXH2 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
SCHEMBL28565289 0.95 MEN1 (0.54) MEN1KMT2AHPGDCA12CA1
SCHEMBL28564670 0.86 HPGD (0.56) HPGDACACBACACAMAPTNPC1
SCHEMBL17907458 0.75 MEN1 (0.54) MEN1KMT2AHPGDCA12CA1
Biphenyl SCHEMBL21812299 0.74 KMT2A (0.42) MEN1KMT2AHPGDNPC1RAB9A
SCHEMBL17907463 0.72 RECQL (0.54) HPGDCA12CA1CA2CA7
SCHEMBL10720887 0.71 RECQL (0.63) MEN1KMT2AHPGDCA12CA1
SCHEMBL17042187 0.70 SLC6A4 (0.42) MEN1KMT2AHPGDRECQLMAPT
SCHEMBL28242578 0.70 NPC1 (0.54) KMT2AHPGDMAPTNPC1RAB9A
SCHEMBL29549626 0.69 WDR5 (0.56) MEN1KMT2AHPGDMAPTNPC1
SCHEMBL10499412 0.69 WDR5 (0.56) MEN1KMT2AHPGDMAPTNPC1

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
CN-108350270-B Polyamide resin composition and film 宇部兴产株式会社 2021-05-11 CN disclosed