SCHEMBL5759686

SCHEMBL5759686

CC(C)N1CCC(CNc2ccc(Cl)cc2C(=O)Nc2ccccn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 10/20 0.58
▸ KCNMA1 Q12791 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ F2 P00734 1/20 0.42
▸ HTR4 Q13639 1/20 0.42
▸ FFAR2 O15552 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ NR3C1 P04150 1/20 0.41
▸ MCHR1 Q99705 1/20 0.41
▸ GRIK1 P39086 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ HRH3 Q9Y5N1 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
SCHEMBL6107968 0.89 F10 (0.73) F10F2
SCHEMBL6108762 0.86 F10 (0.65) F10F2
SCHEMBL6107514 0.86 F10 (0.64) F10F2FFAR2
SCHEMBL5758058 0.84 KCNMA1 (0.55) F10KCNMA1KDM4EGAAHPGD
SCHEMBL5758733 0.84 KDM4E (0.48) F10KCNMA1KDM4EGAAHPGD
SCHEMBL6107570 0.83 F10 (0.60) F10ALOX15F2TDP1
SCHEMBL6108954 0.83 F10 (0.65) F10TSHRF2
SCHEMBL6106469 0.82 F10 (0.64) F10TSHRF2
SCHEMBL6108134 0.81 F10 (0.62) F10
Hydrochloric Acid SCHEMBL6109850 0.81 F10 (0.62) F10

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
EP-1140881-B1 ANTITHROMBOTIC AMIDES LILLY CO ELI (US) 2006-05-17 — — EP disclosed
US-6780878-B2 ANTICOAGULANTS; CARDIOVASACULAR DISORDERS ELI LILLY AND COMPANY 2004-08-24 — — US disclosed
US-6716839-B2 INHIBITOR OF FACTOR XA ELI LILLY AND COMPANY 2004-04-06 — — US disclosed
US-6716855-B2 INHIBITOR OF FACTOR XA; N1-(BENZOYL)-N2-(1-(4-PYRIDYL)PIPERIDIN-4-YL-METHYL)-1,2-BENZENDIAMINE HIGH BIOAVAILABILITY ELI LILLY AND COMPANY 2004-04-06 — — US disclosed
US-6710057-B2 INHIBITORS OF FACTOR XA, AS ANTICOAGULANTS FOR PROPHYLAXIS AND TREATMENT OF THROMBOEMBOLIC DISORDERS ELI LILLY AND COMPANY 2004-03-23 — — US disclosed
US-20030212069-A1 Antithrombotic amides ARGENTUM PHARMACEUTICALS LLC 2003-11-13 — — US disclosed
US-20030199504-A1 Antithrombotic amides ARGENTUM PHARMACEUTICALS LLC 2003-10-23 — — US disclosed
US-20030199505-A1 Antithrombotic amides ARGENTUM PHARMACEUTICALS LLC 2003-10-23 — — US disclosed
US-20030191153-A1 Antithrombotic amides ARGENTUM PHARMACEUTICALS LLC 2003-10-09 — — US disclosed
US-6610704-B1 Inhibit factor Xa ELI LILLY AND COMPANY 2003-08-26 — — 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 (4 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-20030191153-A1 Antithrombotic amides F11, TFPI, SERPINC1 F10 13/4885KCNMA1 1137/4885KDM4E 2930/4885
US-20030199504-A1 Antithrombotic amides F11, TFPI, SERPINC1 F10 13/4885KCNMA1 1137/4885KDM4E 2930/4885
US-20030212069-A1 Antithrombotic amides F11, TFPI, SERPINC1 F10 13/4885KCNMA1 1137/4885KDM4E 2930/4885
US-20030199505-A1 Antithrombotic amides F11, TFPI, SERPINC1 F10 13/4885KCNMA1 1137/4885KDM4E 2930/4885

“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.

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