SCHEMBL10054824

SCHEMBL10054824

Cc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/c1cncnc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ KMT2A Q03164 5/20 0.51
▸ MAPT P10636 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ TP53 P04637 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ ALDH1A1 P00352 6/20 0.50
▸ NPC1 O15118 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ HTT P42858 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ POLB P06746 1/20 0.48
▸ TRPV1 Q8NER1 1/20 0.47
▸ LMNA P02545 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
SCHEMBL2679819 1.00 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AMAPTMEN1KDM4E
SCHEMBL2679821 1.00 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AMAPTMEN1KDM4E
SCHEMBL10054788 0.88 MAPT (0.59) SMN1; SMN2MAPTALDH1A1NPC1RAB9A
SCHEMBL10054825 0.81 MMP1 (0.47) KDM4ETP53TRPV1
SCHEMBL2679345 0.81 MMP1 (0.47) KDM4ETP53TRPV1
SCHEMBL2679342 0.81 MMP1 (0.47) KDM4ETP53TRPV1
SCHEMBL7822334 0.79 ALDH1A1 (0.67) SMN1; SMN2KMT2AMAPTMEN1KDM4E
SCHEMBL7822330 0.79 ALDH1A1 (0.67) SMN1; SMN2KMT2AMAPTMEN1KDM4E
SCHEMBL10077223 0.79 MMP1 (0.45) SMN1; SMN2MAPTKDM4ETP53TRPV1
SCHEMBL2679665 0.78 ALDH1A1 (0.54) SMN1; SMN2KMT2AMAPTMEN1KDM4E

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-8426446-B2 Acrylamide derivative and use thereof in manufacture of medicament BEIJING SHIQIAO BIOPHARM CO. LTD. (CN) 2013-04-23 — — US disclosed
US-8426446-B2 Acrylamide derivative and use thereof in manufacture of medicament BEIJING SHIQIAO BIOPHARM CO. LTD. (CN) 2013-04-23 — — US disclosed
US-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament BEIJING JIASHILIANBO PHARM SCI & TECH CO. LTD 2012-05-10 — — 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-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament ABL1, ABL2, BCR SMN1; SMN2 4655/4885KMT2A 1073/4885MAPT 1476/4885

“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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