SCHEMBL6554935

SCHEMBL6554935

N=C(N)c1ccc(O)c(CNC(=O)c2ccc(C(=O)N3CCCC3)c(OC(F)(F)F)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.47
PRSS1 P07477 2/20 0.47
F2 P00734 4/20 0.45
SLC6A4 P31645 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
CACNA1B Q00975 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
EPHX2 P34913 2/20 0.39
DDR1 Q08345 6/20 0.38
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL7565439 0.99 F10 (0.46) F10PRSS1F2SLC6A4HRH3
SCHEMBL6554861 0.86 F10 (0.42) F10PRSS1F2CACNA1BALDH1A1
Hydrochloric Acid SCHEMBL7565314 0.85 F10 (0.42) F10PRSS1F2CACNA1BALDH1A1
SCHEMBL2997517 0.84 F10 (0.45) F10PRSS1F2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL6554962 0.83 F10 (0.44) F10PRSS1F2ALDH1A1LMNA
SCHEMBL7560748 0.83 F10 (0.44) F10PRSS1F2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL6554511 0.82 F10 (0.43) F10PRSS1F2ALDH1A1LMNA
SCHEMBL6554736 0.79 DDR1 (0.41) F10PRSS1F2DDR1
SCHEMBL7563218 0.79 F10 (0.46) F10PRSS1F2ALDH1A1LMNA
SCHEMBL7561787 0.75 F10 (0.52) F10PRSS1F2ALDH1A1LMNA

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
EP-1390357-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-02-25 EP claimed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 US claimed
WO-2002062778-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-15 WO claimed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 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-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 F10 35/4885PRSS1 776/4885F2 3/4885

“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.