SCHEMBL1219843

SCHEMBL1219843

FC(F)Oc1ccc(-c2cc(CCl)on2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.47
▸ NPC1 O15118 5/20 0.47
▸ L3MBTL1 Q9Y468 6/20 0.45
▸ MAPT P10636 5/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ SMN1; SMN2 Q16637 9/20 0.44
▸ NOTUM Q6P988 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ POLB P06746 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TDP1 Q9NUW8 3/20 0.43
▸ CYP1A2 P05177 2/20 0.41
▸ JAK2 O60674 1/20 0.39
▸ CXCR1 P25024 1/20 0.39
▸ CYP2D6 P10635 1/20 0.38

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
SCHEMBL1221654 0.85 L3MBTL1 (0.48) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1219704 0.83 RAB9A (0.45) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1221236 0.83 SMN1; SMN2 (0.40) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1220996 0.81 DRD2 (0.35) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1221306 0.80 MAPT (0.66) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1220628 0.80 L3MBTL1 (0.43) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1220932 0.79 RAB9A (0.47) RAB9ANPC1L3MBTL1MAPTCYP3A4
SCHEMBL1221719 0.79 SMN1; SMN2 (0.50) RAB9ANPC1L3MBTL1MAPTCYP2C9
SCHEMBL541998 0.78 MAPT (0.56) RAB9ANPC1L3MBTL1MAPTSMN1; SMN2
SCHEMBL1221372 0.77 RAB9A (0.51) RAB9ANPC1L3MBTL1MAPTSMN1; SMN2

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-20110044943-A1 Anti-Viral Compounds, Compositions, And Methods Of Use GLAXOSMITHKLINE LLC 2011-02-24 — — US disclosed
WO-2010081145-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GLAXOSMITHKLINE LLC (US) 2010-07-15 — — WO disclosed
EP-2178877-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GlaxoSmithKline LLC (US) 2010-04-28 — — EP disclosed
US-20100029655-A1 Processes For The Preparation Of Anti-Viral Compounds And Compositions Containing Them LEIVERS MARTIN ROBERT 2010-02-04 — — US disclosed
WO-2010006096-A1 PROCESSES FOR THE PREPARATION OF ANTI-VIRAL COMPOUNDS AND COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM CORPORATION (US) 2010-01-14 — — WO disclosed
US-20090197880-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. 2009-08-06 — — US disclosed
US-20090074717-A1 Anti-viral compounds, compositions, and methods of use GLAXOSMITHKLINE LLC 2009-03-19 — — US disclosed
WO-2009011787-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. (US) 2009-01-22 — — 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 (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-20090074717-A1 Anti-viral compounds, compositions, and methods of use HAVCR2, SARS1, RPL35 RAB9A 2101/4885NPC1 228/4885L3MBTL1 3512/4885
US-20110044943-A1 Anti-Viral Compounds, Compositions, And Methods Of Use HAVCR2, SARS1, RPL35 RAB9A 2101/4885NPC1 228/4885L3MBTL1 3512/4885
US-20090197880-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE HAVCR2, SARS1, RPL35 RAB9A 2101/4885NPC1 228/4885L3MBTL1 3512/4885
US-20100029655-A1 Processes For The Preparation Of Anti-Viral Compounds And Compositions Containing Them RPL35, HAVCR2, RPL5 RAB9A 1911/4885NPC1 1585/4885L3MBTL1 4728/4885

“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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