SCHEMBL1767574

SCHEMBL1767574

O=C(NCc1ccccc1)c1ccnc(N2CCCCC2=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ HTT P42858 1/20 0.54
▸ KLKB1 P03952 2/20 0.51
▸ KLK1 P06870 2/20 0.51
▸ MAPT P10636 1/20 0.50
▸ TP53 P04637 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ NAMPT P43490 1/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ HDAC1 Q13547 2/20 0.47
▸ KDM1A O60341 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ METTL3 Q86U44 1/20 0.47
▸ METTL14 Q9HCE5 1/20 0.47
▸ CNR1 P21554 1/20 0.47

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
SCHEMBL1569230 0.81 LMNA (0.49) LMNASMN1; SMN2HTTRAB9AHDAC1
SCHEMBL1767540 0.81 SMN1; SMN2 (0.47) LMNASMN1; SMN2HTTTP53RAB9A
SCHEMBL3278554 0.77 NPC1 (0.79) LMNASMN1; SMN2MAPTNPC1RAB9A
SCHEMBL24473869 0.77 ALDH1A1 (0.56) MAPTALDH1A1KDM4EKDM5AKDM5C
SCHEMBL1568693 0.77 SCD (0.62) LMNASMN1; SMN2HTTMAPTTP53
SCHEMBL1767391 0.76 SCD (0.52) LMNASMN1; SMN2HTTRAB9AMEN1
SCHEMBL1767355 0.76 SCD (0.62) LMNASMN1; SMN2HTTMAPTHDAC1
SCHEMBL13574978 0.76 KDM4B (0.45) KLKB1KLK1NPC1RAB9AMEN1
SCHEMBL13383550 0.75 KDM4E (0.76) LMNASMN1; SMN2HTTHDAC1KDM1A
SCHEMBL1767528 0.74 ADORA3 (0.55) LMNASMN1; SMN2HTTMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160289191-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2016-10-06 — — US disclosed
US-20160289191-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2016-10-06 — — US disclosed
US-20160289191-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2016-10-06 — — US disclosed
US-9187426-B2 Organic compounds NOVARTIS AG (CH) 2015-11-17 — — US disclosed
US-9187426-B2 Organic compounds NOVARTIS AG (CH) 2015-11-17 — — US disclosed
US-9187426-B2 Organic compounds NOVARTIS AG (CH) 2015-11-17 — — US disclosed
CN-102119152-B Organic compounds NOVARTIS AG 2014-07-02 — — CN disclosed
CN-102119152-A Organic compounds NOVARTIS AG 2011-07-06 — — CN disclosed
US-20110105530-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2011-05-05 — — US disclosed
US-20110105530-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2011-05-05 — — US disclosed
US-20110105530-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2011-05-05 — — US disclosed
WO-2009156484-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-30 — — 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 (2 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-20110105530-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 LMNA 2176/4885SMN1; SMN2 3581/4885HTT 2592/4885
US-20160289191-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 LMNA 2176/4885SMN1; SMN2 3581/4885HTT 2592/4885

“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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