SCHEMBL6109660

SCHEMBL6109660

Cc1ccc(NCC2CCN(C(C)C)CC2)c(C(=O)Nc2ccc(F)cn2)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 5/20 0.51
▸ CRHR1 P34998 2/20 0.44
▸ HCRTR1 O43613 7/20 0.43
▸ HCRTR2 O43614 1/20 0.41
▸ GRM5 P41594 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ HTR4 Q13639 1/20 0.39

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
SCHEMBL6107514 0.90 F10 (0.64) F10CRHR1
SCHEMBL6108954 0.89 F10 (0.65) F10
SCHEMBL6106469 0.87 F10 (0.64) F10CRHR1HCRTR1
SCHEMBL6108762 0.86 F10 (0.65) F10
SCHEMBL6108204 0.85 CRHR1 (0.47) F10CRHR1HCRTR1HCRTR2GRM5
SCHEMBL6107968 0.83 F10 (0.73) F10
SCHEMBL6112113 0.82 F10 (0.55) F10
SCHEMBL6109662 0.79 F10 (0.45) F10HCRTR1HCRTR2GRM5KDM4E
Hydrochloric Acid SCHEMBL6109850 0.78 F10 (0.62) F10
SCHEMBL6111007 0.78 F10 (0.55) 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 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 F10 12/4885CRHR1 3637/4885HCRTR1 3611/4885
US-20050282862-A1 Aromatic amides F11, F12, F5 F10 12/4885CRHR1 3637/4885HCRTR1 3611/4885

“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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