SCHEMBL20964693

SCHEMBL20964693

CCC(C)CC(=O)Nc1ccc(C)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.48
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 2/20 0.46
HSD17B10 Q99714 1/20 0.46
TP53 P04637 1/20 0.46
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
ALOX12 P18054 1/20 0.45

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
SCHEMBL20964640 0.87 MEN1 (0.53) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL9313923 0.81 MEN1 (0.68) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL30022414 0.80 RAB9A (0.54) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL22722429 0.79 POLB (0.59) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL10176583 0.79 MEN1 (0.59) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL7264600 0.79 ALDH1A1 (0.73) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL31570084 0.77 MEN1 (0.57) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL9292088 0.77 MEN1 (0.57) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL22722430 0.77 POLB (0.61) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL23130363 0.76 RAB9A (0.53) KDM4ERAB9ANPC1KMT2AMEN1

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-20190127361-A1 Therapeutic Compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-05-02 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 (1 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-20190127361-A1 Therapeutic Compounds SDHA, SLC10A1, SERPINC1 KDM4E 4616/4885RAB9A 426/4885NPC1 11/4885

“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.