SCHEMBL401767

SCHEMBL401767

CCc1ccc(NC(=O)Nc2cc(CN3CCC[C@H](N(C)C(=O)C(C)C)C3)ccc2F)cn1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 6/20 0.38
MEN1 O00255 5/20 0.38
EPHX2 P34913 4/20 0.38
POLB P06746 2/20 0.37
CCR3 P51677 3/20 0.37
ADRB2 P07550 1/20 0.37
TARDBP Q13148 1/20 0.36

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
SCHEMBL544986 0.91 KMT2A (0.41) KDM4ERAB9AKMT2AMEN1EPHX2
SCHEMBL399032 0.91 KMT2A (0.41) KDM4ERAB9AKMT2AMEN1EPHX2
SCHEMBL4012403 0.91 KMT2A (0.41) KDM4ERAB9AKMT2AMEN1EPHX2
SCHEMBL4011647 0.86 CCR3 (0.40) RAB9AKMT2AMEN1CCR3
SCHEMBL399042 0.86 CCR3 (0.40) RAB9AKMT2AMEN1CCR3
SCHEMBL398795 0.86 CCR3 (0.40) RAB9AKMT2AMEN1CCR3
SCHEMBL400551 0.82 ADRB2 (0.41) KDM4ERAB9AKMT2AMEN1EPHX2
SCHEMBL400753 0.82 ADRB2 (0.41) KDM4ERAB9AKMT2AMEN1EPHX2
SCHEMBL4003553 0.82 ADRB2 (0.41) KDM4ERAB9AKMT2AMEN1EPHX2
SCHEMBL545169 0.82 ADRB2 (0.44) KDM4ERAB9AKMT2AMEN1EPHX2

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-8101617-B2 Disubstituted ureas and uses thereof in treating heart failure AMGEN, INC. (US) 2012-01-24 US disclosed
US-20090099198-A1 Compounds, Compositions and Methods CYTOKINETICS, INC. 2009-04-16 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-20090099198-A1 Compounds, Compositions and Methods TNNI3, TNNC1, TNNT2 KDM4E 2421/4885RAB9A 2773/4885KMT2A 4396/4885

“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.