SCHEMBL4275046

SCHEMBL4275046

CC(=O)Oc1cc(C)ccc1C(=S)Nc1cccnc1C(=O)Nc1ccc(Cl)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.44
RAB9A P51151 6/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
TP53 P04637 3/20 0.43
TSHR P16473 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
NPC1 O15118 5/20 0.42
ALOX15 P16050 2/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL4268856 0.86 F10 (0.49) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4270000 0.85 F10 (0.44) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4274181 0.85 F10 (0.42) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4274175 0.85 F10 (0.42) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4278830 0.82 METAP1 (0.41) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4279540 0.81 KDR (0.56) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4270070 0.81 METAP1 (0.40) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL13608691 0.81 NPC1 (0.64) F10RAB9ASMN1; SMN2NPC1ALOX15
SCHEMBL4274401 0.80 CACNB4 (0.42) F10RAB9ASMN1; SMN2TP53TSHR
SCHEMBL4274405 0.80 CACNB4 (0.42) F10RAB9ASMN1; SMN2TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615568-B2 3-[2-(cis-4-aminocyclohexyloxy)-4-methylsulfonylbenzoyl-amino]-N-(5-chloropyridin-2-yl)pyridine-2-carboxamide,; anticoagulant; platelet glycoprotein receptor antagonist; thrombosis; orally; acylation of amino-pyridine by (methylthio)benzoic acid followed by oxidation, alkylation, carbonylation ELI LILLY AND COMPANY (US) 2009-11-10 US disclosed
US-20080108594-A1 Antithrombotic Ethers ELI LILLY AND COMPANY (US) 2008-05-08 US disclosed
EP-1644334-B1 ANTITHROMBOTIC ETHERS LILLY CO ELI (US) 2008-01-02 EP disclosed
EP-1644334-A1 ANTITHROMBOTIC ETHERS Eli Lilly and Company (US) 2006-04-12 EP disclosed
WO-2004108677-A1 ANTITHROMBOTIC ETHERS ELI LILLY AND COMPANY (US) 2004-12-16 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-20080108594-A1 Antithrombotic Ethers F11, SERPINC1, F2 F10 16/4885RAB9A 2540/4885SMN1; SMN2 4162/4885

“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.