SCHEMBL6107157

SCHEMBL6107157

O=C(Nc1ccccc1C(=O)Nc1ccc(Cl)cn1)OCC1CCNCC1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 5/20 0.64
▸ CHRM1 P11229 5/20 0.64
▸ CHRM3 P20309 5/20 0.64
▸ F10 P00742 13/20 0.54
▸ NPC1 O15118 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49

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
Trifluoroacetic Acid SCHEMBL6108839 0.94 CHRM3 (0.57) CHRM2CHRM1CHRM3F10SMN1; SMN2
SCHEMBL6108672 0.85 F10 (0.56) CHRM3F10NPC1ALOX15HTT
SCHEMBL6107404 0.85 NPC1 (0.52) CHRM2CHRM1CHRM3F10NPC1
Hydrochloric Acid SCHEMBL6106700 0.85 F10 (0.58) CHRM3F10NPC1ALOX15HTT
SCHEMBL6107029 0.84 F10 (0.55) F10NPC1ALOX15HTTRAB9A
SCHEMBL6107073 0.82 F10 (0.48) F10
SCHEMBL6106846 0.82 BCHE (0.52) CHRM3F10
Trifluoroacetic Acid SCHEMBL6110275 0.79 F10 (0.51) CHRM3F10NPC1ALOX15HTT
Hydrochloric Acid SCHEMBL6106707 0.79 F10 (0.50) F10NPC1ALOX15HTTRAB9A
SCHEMBL6107083 0.78 F10 (0.47) F10NPC1ALOX15HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7129245-B2 Anticoagulants which act selectively on factor Xa; fast acting; oral; do not interfere with lysis of blood clots ELI LILLY AND COMPANY (US) 2006-10-31 — — US disclosed
US-20050282862-A1 Aromatic amides BEIGHT DOUGLAS W 2005-12-22 — — US disclosed
EP-1140903-B1 AROMATIC AMIDES LILLY CO ELI (US) 2004-08-04 — — EP disclosed
US-6759414-B2 ANTICOAGULANTS WHICH ACT SELECTIVELY ON FACTOR XA; FAST ACTING; ORAL; DO NOT INTERFERE WITH LYSIS OF BLOOD CLOTS ELI LILLY AND COMPANY 2004-07-06 — — US disclosed
US-20040029874-A1 Aromatic amides BEIGHT DOUGLAS WADE (US) 2004-02-12 — — US disclosed
US-6635657-B1 Pyridine derivatives; anticoagulants ELI LILLY AND COMPANY 2003-10-21 — — US disclosed
EP-1140903-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2001-10-10 — — EP disclosed
WO-2000039118-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2000-07-06 — — 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-20040029874-A1 Aromatic amides F11, F12, F5 CHRM2 3401/4885CHRM1 3059/4885CHRM3 4142/4885
US-20050282862-A1 Aromatic amides F11, F12, F5 CHRM2 3401/4885CHRM1 3059/4885CHRM3 4142/4885

“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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