SCHEMBL6850182

SCHEMBL6850182

CCOC(=O)CCn1c(C)cnc(NNS(=O)(=O)Cc2ccccc2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
F2 P00734 7/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TNF P01375 1/20 0.37
LTA4H P09960 1/20 0.37

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
SCHEMBL6846378 0.83 KDM4E (0.44) KDM4EALDH1A1F2TSHRHPGD
SCHEMBL6850301 0.81 KDM4E (0.41) KDM4EALDH1A1F2HPGD
SCHEMBL6850252 0.76 F2 (0.56) KDM4EALDH1A1MEN1KMT2AF2
SCHEMBL7736669 0.76 TNF (0.46) ALDH1A1TNF
SCHEMBL7737504 0.76 F2 (0.44) KDM4EALDH1A1F2
SCHEMBL6849324 0.73 MASP2 (0.38) KDM4EALDH1A1F2HPGD
SCHEMBL6848920 0.70 TNF (0.50) KDM4EALDH1A1MAPTTNF
SCHEMBL6848928 0.69 TNF (0.49) KDM4EALDH1A1TNF
SCHEMBL6850663 0.68 F2 (0.64) F2
SCHEMBL23460608 0.68 F2 (0.54) KDM4EALDH1A1MEN1KMT2AF2

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-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
US-20030092679-A1 Novel non-convalent thrombin inhibitors DENDREON PHARMACEUTICALS LLC 2003-05-15 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-20030092679-A1 Novel non-convalent thrombin inhibitors F2, SERPINC1, F2RL3 KDM4E 3434/4885ALDH1A1 4674/4885MEN1 1443/4885

“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.