SCHEMBL3122154

SCHEMBL3122154

Cc1cc(=O)n(-c2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)cn2)[nH]1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.52
▸ TRPV1 Q8NER1 4/20 0.50
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ ABL1 P00519 7/20 0.47
▸ MAPT P10636 3/20 0.47
▸ SCN10A Q9Y5Y9 1/20 0.46

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
SCHEMBL3117348 0.88 SMN1; SMN2 (0.58) TRPV1RAB9ASMN1; SMN2MAPT
SCHEMBL3109283 0.87 PTPN1 (0.51) NPC1RAB9AKMT2ASMN1; SMN2MAPT
SCHEMBL3120279 0.85 RAB9A (0.57) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL3117290 0.85 TRPV1 (0.47) TRPV1NPC1RAB9AMEN1KMT2A
SCHEMBL3116564 0.83 PTPN1 (0.50) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL3116048 0.82 P4HTM (0.54) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL3107074 0.81 CYP11B1 (0.46) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL13248873 0.80 NPY5R (0.49) MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL3117708 0.79 KCNQ3 (0.56) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL14609473 0.77 ULK1 (0.47) KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 — — US disclosed
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 — — US disclosed
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 — — US disclosed
CN-101291923-A Pyrazolone derivatives for the treatment of tuberculosis ASTRAZENECA AB (SE) 2008-10-22 — — CN disclosed
EP-1919890-A1 PYRAZOLONE DERIVATIVES FOR THE TREATMENT OF TUBERCULOSIS AstraZeneca AB (SE) 2008-05-14 — — EP disclosed
WO-2007020426-A1 PYRAZOLONE DERIVATIVES FOR THE TREATMENT OF TUBERCULOSIS ASTRAZENECA AB (SE) 2007-02-22 — — 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 (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-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS TREH, TYMP, EPX LMNA 1808/4885TRPV1 2392/4885NPC1 2396/4885

“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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