SCHEMBL7229397

SCHEMBL7229397

NC(=O)c1cc(-c2ccc(C(=O)O)cc2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.58
MKNK2 Q9HBH9 3/20 0.58
MYC P01106 1/20 0.53
MAP4K4 O95819 2/20 0.51
KDM4E B2RXH2 2/20 0.50
KDM6B O15054 1/20 0.50
TET3 O43151 1/20 0.50
KDM4A O75164 1/20 0.50
BBOX1 O75936 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
KDM5A P29375 1/20 0.50
KDM5C P41229 1/20 0.50
ASPH Q12797 1/20 0.50
KDM4D Q6B0I6 1/20 0.50
TET2 Q6N021 1/20 0.50
ALKBH5 Q6P6C2 1/20 0.50
KDM7A Q6ZMT4 1/20 0.50
KDM8 Q8N371 1/20 0.50
TET1 Q8NFU7 1/20 0.50

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
SCHEMBL28284992 0.87 KDM4E (0.66) MKNK1MKNK2KDM4EKDM6BTET3
SCHEMBL29735324 0.84 PLAU (0.54) MKNK1MKNK2MYCALDH1A1KMO
SCHEMBL2935534 0.84 PLAU (0.54) MKNK1MKNK2MYCALDH1A1KMO
Hydrochloric Acid SCHEMBL9792812 0.83 MKNK1 (0.52) MKNK1MKNK2MYCMAP4K4KDM4E
SCHEMBL7064288 0.82 MKNK1 (0.57) MKNK1MKNK2MYCMAP4K4ALDH1A1
SCHEMBL7720509 0.82 KDM5C (0.74) KDM4EKDM6BTET3KDM4ABBOX1
SCHEMBL29516759 0.82 CHUK (0.56) MKNK1MKNK2MYCMAP4K4MAPT
SCHEMBL7223701 0.81 MKNK1 (0.53) MKNK1MKNK2MYCMAP4K4KDM4E
SCHEMBL18076173 0.81 MKNK1 (0.51) MKNK1MKNK2MYCMAP4K4KDM4E
SCHEMBL27772527 0.81 MKNK1 (0.51) MKNK1MKNK2MYCMAP4K4KMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030153604-A1 Substituted (aminoiminomethyl or aminomethyl) benzoheteroaryl compounds AVENTIS PHARMACEUTICALS INC. 2003-08-14 US disclosed
US-6541505-B1 Inhibiting the activity of Factor Xa; treating a disease state associated with a physiologically detrimental excess amount of thrombin. AVENTIS PHARMACEUTICALS INC. 2003-04-01 US disclosed
EP-1140901-A2 SUBSTITUTED (AMINOIMINOMETHYL OR AMINOMETHYL)BENZOHETEROARYL COMPOUNDS AS FACTOR XA INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2001-10-10 EP disclosed
WO-2000039087-A2 SUBSTITUTED (AMINOIMINOMETHYL OR AMINOMETHYL)BENZOHETEROARYL COMPOUNDS AS FACTOR XA INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-07-06 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 (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-20030153604-A1 Substituted (aminoiminomethyl or aminomethyl) benzoheteroaryl compounds SERPINC1, F2, F11 MKNK1 2498/4885MKNK2 2848/4885MYC 4182/4885

“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.