SCHEMBL19239689

SCHEMBL19239689

CC(C)CCCCNC(=O)CCC(C)C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
CASP2 P42575 1/20 0.48
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
PKM P14618 1/20 0.46
NAAA Q02083 1/20 0.46
HPGD P15428 2/20 0.44
CNR1 P21554 1/20 0.44
NAMPT P43490 1/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
CA1 P00915 2/20 0.41
TP53 P04637 1/20 0.41
KDM4C Q9H3R0 2/20 0.40
KDM4A O75164 1/20 0.40
PHF8 Q9UPP1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
FAAH O00519 1/20 0.39

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
SCHEMBL16689691 0.98 ALDH1A1 (0.53) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL18768756 0.98 ALDH1A1 (0.53) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL22851659 0.98 ALDH1A1 (0.53) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL19239788 0.96 ALDH1A1 (0.52) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL18313728 0.94 ALDH1A1 (0.52) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL16248615 0.94 ALDH1A1 (0.57) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL18513237 0.92 ALDH1A1 (0.52) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL24818366 0.90 NAMPT (0.52) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL10345306 0.90 NAMPT (0.52) ALDH1A1CASP2KMT2AMEN1LMNA
SCHEMBL10660707 0.90 NAMPT (0.52) ALDH1A1CASP2KMT2AMEN1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210139539-A1 NEW ANTIBACTERIAL PRODUCTS THE UNIVERSITY OF LIVERPOOL (GB) 2021-05-13 US disclosed
US-20200407712-A1 ARRAY-BASED CYCLIC PEPTIDE LIBRARIES Cowper Sciences Inc. 2020-12-31 US disclosed
US-20170233405-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2017-08-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210139539-A1 NEW ANTIBACTERIAL PRODUCTS DBI, MRPL21, NRDC ALDH1A1 1816/4885CASP2 870/4885KMT2A 4623/4885
US-20170233405-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MYC, MYCBP, MYCBP2 ALDH1A1 3226/4885CASP2 4465/4885KMT2A 1821/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.