SCHEMBL3765565

SCHEMBL3765565

CC(C)c1nc2ccccc2c(=O)n1NC(=O)CC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 10/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ POLB P06746 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ LMNA P02545 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43

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
SCHEMBL3785819 0.94 P2RX7 (0.44) P2RX7KMT2AMEN1POLBHDAC6
SCHEMBL3759804 0.91 HDAC6 (0.48) P2RX7POLBHDAC6SMN1; SMN2HTT
SCHEMBL3755499 0.90 P2RX7 (0.41) P2RX7KMT2APOLBHDAC6SMN1; SMN2
SCHEMBL3759965 0.88 P2RX7 (0.45) P2RX7KMT2AGLASMN1; SMN2LMNA
SCHEMBL3761284 0.87 HTT (0.58) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL3759959 0.87 P2RX7 (0.41) P2RX7KMT2AGLASMN1; SMN2LMNA
SCHEMBL3762001 0.85 KMT2A (0.50) P2RX7KMT2AMEN1HDAC6GLA
SCHEMBL3760532 0.84 ALDH1A1 (0.57) P2RX7KMT2AMEN1HTTLMNA
SCHEMBL3757585 0.83 P2RX7 (0.47) P2RX7KMT2AMEN1HDAC6GLA
SCHEMBL3759996 0.82 HTT (0.44) KMT2AMEN1SMN1; SMN2HTTLMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962639-B2 Potassium channel modulators ABBVIE INC. (US) 2015-02-24 — — US claimed
WO-2010138828-A2 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2010-12-02 — — WO claimed
US-20100305109-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2010-12-02 — — US claimed
US-8962639-B2 Potassium channel modulators ABBVIE INC. (US) 2015-02-24 — — US disclosed
WO-2010138828-A2 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2010-12-02 — — WO disclosed
US-20100305109-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2010-12-02 — — 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-20100305109-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNJ2 P2RX7 172/4885KMT2A 642/4885MEN1 1599/4885

“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.

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