SCHEMBL3601351

SCHEMBL3601351

[NH]c1ccc2c(c1)CC(N1CCC[C@H]1CO)C(=O)N2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 4/20 0.36
MAPT P10636 4/20 0.36
GAA P10253 4/20 0.36
PARP1 P09874 4/20 0.35
CHEK1 O14757 1/20 0.35
MAP2K1 Q02750 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
ALOX15 P16050 2/20 0.34
HSD17B10 Q99714 2/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
HPGD P15428 3/20 0.33
MEN1 O00255 3/20 0.33
BCL6 P41182 2/20 0.32

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
SCHEMBL3601732 0.91 ALDH1A1 (0.36) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3601354 0.86 KMT2A (0.37) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3597252 0.86 CASP3 (0.41) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3601734 0.80 CA9 (0.37) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3601187 0.78 ALDH1A1 (0.42) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3589646 0.77 KDM4E (0.34) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3599094 0.77 CASP3 (0.39) ALDH1A1KDM4EMAPTGAAPARP1
SCHEMBL13545552 0.77 TRPV1 (0.37) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL13545284 0.77 TRPV1 (0.37) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3580789 0.75 TSHR (0.46) KMT2AALDH1A1KDM4EMAPTGAA

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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 KMT2A 906/4885ALDH1A1 1904/4885KDM4E 2284/4885

“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.