SCHEMBL6169142

SCHEMBL6169142

CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3cc[nH]c3c2)c(NC(=O)OCC2CCN(c3ccncc3)CC2)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXFP2 Q8WXD0 1/20 0.38
PIP4K2A P48426 1/20 0.37
PIP4K2B P78356 1/20 0.37
IDH1 O75874 1/20 0.36
F10 P00742 7/20 0.35
SPHK1 Q9NYA1 1/20 0.35
ESR1 P03372 2/20 0.35
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
KIF18A Q8NI77 1/20 0.34

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
SCHEMBL6169978 0.86 RXFP2 (0.51) RXFP2PIP4K2APIP4K2BF10
SCHEMBL7369776 0.86 F10 (0.36) F10GRIN1GRIN2BKIF18A
SCHEMBL6168830 0.83 F10 (0.36) IDH1F10KIF18A
SCHEMBL6170463 0.81 RXFP2 (0.52) RXFP2PIP4K2APIP4K2BF10
SCHEMBL7374848 0.77 F10 (0.46) F10
SCHEMBL6172046 0.76 RXFP2 (0.54) RXFP2F10
SCHEMBL6169151 0.76 RXFP2 (0.39) RXFP2PIP4K2APIP4K2BIDH1ESR1
SCHEMBL6169459 0.76 F10 (0.41) F10
SCHEMBL7372042 0.75 F10 (0.38) F10
SCHEMBL7369526 0.73 F10 (0.41) F10KIF18A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6372759-B1 BLOOD COAGULATION FACTOR XA FOR MAMMALS ELI LILLY AND COMPANY 2002-04-16 US claimed
EP-1019045-B1 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2005-06-08 EP disclosed
US-20030078431-A1 Antithrombotic agents BEIGHT DOUGLAS WADE (US) 2003-04-24 US disclosed
US-6500851-B2 ANTICOAGULANT IN MAMMLS ELI LILLY AND COMPANY 2002-12-31 US disclosed
US-20020173518-A1 Antithrombotic agents BEIGHT DOUGLAS WADE (US) 2002-11-21 US disclosed
EP-1019045-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-03 EP disclosed
US-6372759-B1 BLOOD COAGULATION FACTOR XA FOR MAMMALS ELI LILLY AND COMPANY 2002-04-16 US disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A9 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 1999-08-05 WO disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 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 (2 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-20020173518-A1 Antithrombotic agents SERPINC1, TFPI, F11 RXFP2 1676/4885PIP4K2A 3424/4885PIP4K2B 3057/4885
US-20030078431-A1 Antithrombotic agents SERPINC1, TFPI, F11 RXFP2 1676/4885PIP4K2A 3424/4885PIP4K2B 3057/4885

“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.