SCHEMBL4520679

SCHEMBL4520679

[NH]C(=O)c1cccc2c1CCC2

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.48
BAD Q92934 1/20 0.48
CXCR5 P32302 4/20 0.48
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 2/20 0.41
RXRA P19793 5/20 0.41
RXRB P28702 5/20 0.41
RXRG P48443 4/20 0.41
LMNA P02545 1/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
KDM4E B2RXH2 2/20 0.40
POLB P06746 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
SCHEMBL4516467 0.96 BCL2L1 (0.53) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL3613341 0.86 CXCR5 (0.53) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL3613338 0.84 BCL2L1 (0.48) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL29351721 0.82 PARP1 (0.51) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL3434922 0.82 PARP1 (0.51) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL3396949 0.82 ALDH1A1 (0.47) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL29573534 0.82 ALDH1A1 (0.47) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL11814300 0.82 BCL2L1 (0.55) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL29493191 0.82 CXCR5 (0.56) BCL2L1BADCXCR5MEN1KMT2A
SCHEMBL783869 0.82 CXCR5 (0.56) BCL2L1BADCXCR5MEN1KMT2A

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-20090233960-A1 Kinase Inhibitors DEVGEN NV (BE) 2009-09-17 US disclosed
EP-1934181-A2 KINASE INHIBITORS Devgen NV (BE) 2008-06-25 EP disclosed
WO-2007042321-A2 KINASE INHIBITORS DEVGEN N.V. (BE) 2007-04-19 WO 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-20090233960-A1 Kinase Inhibitors ROCK1, MAP3K1, MAP3K11 BCL2L1 2657/4885BAD 2060/4885CXCR5 2803/4885

“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.