SCHEMBL22872801

SCHEMBL22872801

CCC(C)CCCCCNC(=O)CN(C)CC(C)C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
CASP2 P42575 1/20 0.36
EPHX1 P07099 4/20 0.36
NAMPT P43490 1/20 0.35
NAAA Q02083 1/20 0.34
DNM1 Q05193 2/20 0.34
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR1 P21554 1/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
MMP8 P22894 1/20 0.32
FAAH O00519 1/20 0.32
HPGD P15428 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
SCHEMBL23589671 0.90 NAMPT (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL23589692 0.90 NAMPT (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL22872802 0.90 NAMPT (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL23589907 0.90 NAMPT (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL23589714 0.90 NAMPT (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL23589715 0.90 NAMPT (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL22301097 0.88 KMT2A (0.39) KMT2AMEN1CASP2EPHX1NAMPT
SCHEMBL21227614 0.85 CASP2 (0.51) KMT2AMEN1CASP2EPHX1NAAA
SCHEMBL25101472 0.85 CASP2 (0.51) KMT2AMEN1CASP2EPHX1NAAA
SCHEMBL22318122 0.83 CASP2 (0.49) KMT2AMEN1CASP2EPHX1NAAA

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-11773085-B2 Methods and compounds for treating disorders FOGHORN THERAPEUTICS INC. (US) 2023-10-03 US disclosed
US-20210009568-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS FOGHORN THERAPEUTICS INC. 2021-01-14 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-11773085-B2 Methods and compounds for treating disorders VHL, TFEB, BECN1 KMT2A 583/4885MEN1 823/4885CASP2 1477/4885
US-20210009568-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS VHL, TFEB, BECN1 KMT2A 583/4885MEN1 823/4885CASP2 1477/4885

“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.