SCHEMBL7225235

SCHEMBL7225235

N=C(N)c1c[nH]c2ccc(CCNC(=O)c3cc4ccc(Cl)cc4s3)cc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.52
DHPS P49366 1/20 0.44
PYGL P06737 1/20 0.44
NHERF1 O14745 2/20 0.43
SNCA P37840 5/20 0.43
NAMPT P43490 1/20 0.43
PLK4 O00444 1/20 0.42
AURKA O14965 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
CHEK2 O96017 1/20 0.42
ROS1 P08922 1/20 0.42
RPS6KB1 P23443 1/20 0.42
MAPK1 P28482 1/20 0.42
FLT4 P35916 1/20 0.42
CLK2 P49760 1/20 0.42
GSK3A P49840 1/20 0.42
IRAK1 P51617 1/20 0.42
PRKX P51817 1/20 0.42
CSNK1G2 P78368 1/20 0.42

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
SCHEMBL7231183 0.84 LMNA (0.43) F10PYGLNHERF1SNCANAMPT
SCHEMBL7222947 0.82 SNCA (0.60) SNCAMEN1KMT2A
SCHEMBL7222687 0.79 SNCA (0.56) SNCA
SCHEMBL7232087 0.78 CA12 (0.48) PYGLNHERF1SNCAMEN1KMT2A
SCHEMBL7229820 0.75 ALDH1A1 (0.56) SNCAMEN1KMT2A
SCHEMBL7234303 0.74 ESRRG (0.54) F10SNCALMNAL3MBTL1
SCHEMBL7224697 0.74 F10 (0.53) F10MEN1KMT2AMAPTLMNA
SCHEMBL7224324 0.73 CDK4 (0.47) F10SNCAPOLBKMT2ALMNA
SCHEMBL7221862 0.72 CA1 (0.59) MEN1KMT2ALMNAL3MBTL1
SCHEMBL7854068 0.71 CNR1 (0.43) F10NAMPTPLK4AURKAPRKD3

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 8 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 claimed
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 claimed
EP-1140901-A2 SUBSTITUTED (AMINOIMINOMETHYL OR AMINOMETHYL)BENZOHETEROARYL COMPOUNDS AS FACTOR XA INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2001-10-10 EP claimed
WO-2000039087-A2 SUBSTITUTED (AMINOIMINOMETHYL OR AMINOMETHYL)BENZOHETEROARYL COMPOUNDS AS FACTOR XA INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-07-06 WO claimed
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 F10 7/4885DHPS 641/4885PYGL 367/4885

“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.