SCHEMBL426663

SCHEMBL426663

CN(C(=O)n1ccc(-c2ccccc2)n1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 2/20 0.48
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.43
SCN9A Q15858 2/20 0.43
LIPE Q05469 3/20 0.41
ACHE P22303 2/20 0.41
KDM4E B2RXH2 4/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
HPGD P15428 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL427262 0.97 SCN4A (0.49) SCN4AKMT2ASMN1; SMN2SCN9ALIPE
SCHEMBL426691 0.89 FYN (0.43) SCN4AKMT2ASMN1; SMN2KDM4ERAB9A
SCHEMBL2181609 0.86 SCN4A (0.62) SCN4AKMT2ASMN1; SMN2SCN9ALIPE
SCHEMBL7901000 0.78 SCN4A (0.43) SCN4AKMT2ASMN1; SMN2SCN9AKDM4E
SCHEMBL22341331 0.77 SCN4A (0.55) SCN4AKMT2ASMN1; SMN2SCN9AKDM4E
SCHEMBL27795462 0.74 SCN4A (0.74) SCN4AKMT2ASMN1; SMN2SCN9AKDM4E
SCHEMBL425530 0.73 ELANE (0.47) KMT2ASMN1; SMN2LIPEKDM4EGAA
SCHEMBL425371 0.73 FAAH (0.60) KMT2ASMN1; SMN2LIPEACHEKDM4E
SCHEMBL17224648 0.72 KMT2A (0.68) SCN4AKMT2ASMN1; SMN2SCN9AKDM4E
SCHEMBL24937768 0.72 SMN1; SMN2 (0.46) KMT2ASMN1; SMN2LIPEACHEKDM4E

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-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 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-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 SCN4A 2103/4885KMT2A 2067/4885SMN1; SMN2 2818/4885

“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.