SCHEMBL5228531

SCHEMBL5228531

COc1ccc(NC(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
NPSR1 Q6W5P4 2/20 0.65
MAPT P10636 7/20 0.65
GALK1 P51570 1/20 0.60
GAA P10253 2/20 0.59
HSD17B10 Q99714 1/20 0.59
PKM P14618 1/20 0.57
TP53 P04637 2/20 0.56
POLB P06746 2/20 0.56
F10 P00742 3/20 0.54
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NR1H4 Q96RI1 2/20 0.50
TSHR P16473 1/20 0.48

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
SCHEMBL5225715 0.82 F10 (0.76) MEN1KMT2AMAPTTP53POLB
SCHEMBL5226610 0.82 NR1H4 (0.60) MEN1KMT2ATP53F10ALDH1A1
SCHEMBL5225091 0.80 F10 (0.61) MEN1KMT2AMAPTTP53POLB
SCHEMBL5225151 0.80 F10 (0.61) MEN1KMT2AMAPTTP53POLB
SCHEMBL5222102 0.78 NR1H4 (0.64) MAPTGAATP53F10LMNA
SCHEMBL5228240 0.76 NR1H4 (0.62) MEN1KMT2AMAPTGAAPKM
SCHEMBL5225486 0.75 NR1H4 (0.63) MEN1KMT2AMAPTTP53POLB
SCHEMBL5223117 0.74 F10 (0.64) MEN1KMT2AMAPTTP53POLB
SCHEMBL5222813 0.74 NR1H4 (0.60) MEN1KMT2ATP53ALDH1A1LMNA
SCHEMBL5224050 0.73 NR1H4 (0.60) MEN1KMT2AMAPTTP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1014962-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2007-06-27 EP disclosed
US-6605626-B2 Benzamide inhibitors of factor Xa ELI LILLY AND COMPANY 2003-08-12 US disclosed
US-20020120007-A1 Benzamide inhibitors of factor Xa BEIGHT DOUGLAS WADE (US) 2002-08-29 US disclosed
US-6313122-B1 AS INHIBITORS OF FACTOR XA AND ARE USED AS ANTICOAGULANTS IN MAMMALS ELI LILLY AND COMPANY 2001-11-06 US disclosed
EP-1014962-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
WO-1999000121-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 (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-20020120007-A1 Benzamide inhibitors of factor Xa TFPI, F11, F12 MEN1 1119/4885KMT2A 2083/4885NPSR1 2391/4885

“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.