SCHEMBL6714678

SCHEMBL6714678

CC(C)C(Nc1ccccc1C(=O)Nc1ccc(Cl)cn1)C1CCNCC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ F10 P00742 16/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
Hydrochloric Acid SCHEMBL6710608 0.90 NPC1 (0.53) NPC1ALOX15HTTRAB9AF10
SCHEMBL6411338 0.89 NPC1 (0.53) NPC1ALOX15HTTRAB9AF10
SCHEMBL7365101 0.88 F10 (0.46) NPC1ALOX15HTTRAB9AF10
Hydrochloric Acid SCHEMBL7444958 0.88 NPC1 (0.46) NPC1ALOX15HTTRAB9AF10
Hydrochloric Acid SCHEMBL7448873 0.88 NPC1 (0.46) NPC1ALOX15HTTRAB9AF10
Hydrochloric Acid SCHEMBL7358233 0.86 F10 (0.49) F10
SCHEMBL7358930 0.86 F10 (0.52) NPC1ALOX15HTTRAB9AF10
SCHEMBL7365896 0.86 F10 (0.52) NPC1ALOX15HTTRAB9AF10
Hydrochloric Acid SCHEMBL7446146 0.85 F10 (0.49) NPC1ALOX15HTTRAB9AF10
SCHEMBL6713141 0.85 F10 (0.50) NPC1ALOX15HTTRAB9AF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 (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-20040029874-A1 Aromatic amides F11, F12, F5 NPC1 1659/4885ALOX15 2156/4885HTT 2573/4885

“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.

Send feedback