SCHEMBL1353240

SCHEMBL1353240

COc1ccc(C(=O)O)cc1C(=O)Nc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 2/20 0.61
▸ POLB P06746 1/20 0.61
▸ ABL1 P00519 7/20 0.59
▸ KCNH2 Q12809 1/20 0.58
▸ TRPV1 Q8NER1 3/20 0.55
▸ FAAH O00519 1/20 0.55
▸ EPHX2 P34913 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54

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
SCHEMBL1353242 0.91 ABL1 (0.65) HDAC8POLBABL1KCNH2TRPV1
SCHEMBL1354062 0.89 HDAC8 (0.60) HDAC8POLBABL1KCNH2TRPV1
SCHEMBL1352674 0.86 HDAC8 (0.57) HDAC8ABL1KCNH2TRPV1MEN1
SCHEMBL12132659 0.81 HDAC8 (0.79) HDAC8POLBMEN1KMT2ANPC1
SCHEMBL15920763 0.81 EPHX2 (0.57) HDAC8ABL1TRPV1FAAHEPHX2
SCHEMBL15931119 0.80 FAAH (0.60) TRPV1FAAHEPHX2
SCHEMBL15392218 0.80 ABL1 (0.66) POLBABL1KCNH2TRPV1MEN1
SCHEMBL15561842 0.79 FAAH (0.62) FAAHEPHX2
SCHEMBL23090385 0.77 DHODH (0.70) ABL1KCNH2TRPV1EPHX2MEN1
SCHEMBL11466437 0.76 MEN1 (0.81) HDAC8POLBMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063046-B2 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-11-22 — — US disclosed
US-8063046-B2 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-11-22 — — US disclosed
EP-1698618-B1 BENZAMIDE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2011-05-18 — — EP disclosed
US-20100179326-A1 BENZAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-07-15 — — US disclosed
US-20100179326-A1 BENZAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-07-15 — — US disclosed
US-20100179326-A1 BENZAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-07-15 — — US disclosed
US-7705053-B2 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-04-27 — — US disclosed
US-7705053-B2 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-04-27 — — US disclosed
US-7705053-B2 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-04-27 — — US disclosed
US-20070123493-A1 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-31 — — US disclosed
US-20070123493-A1 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-31 — — US disclosed
US-20070123493-A1 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-31 — — US disclosed
EP-1698618-A1 BENZAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-09-06 — — EP 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-20070123493-A1 Benzamide derivative BDKRB1, BDKRB2, NR1H2 HDAC8 305/4885POLB 4318/4885ABL1 2551/4885
US-20100179326-A1 BENZAMIDE DERIVATIVE NR0B2, NR1H2, CNR2 HDAC8 407/4885POLB 3795/4885ABL1 2714/4885

“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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