SCHEMBL5506646

SCHEMBL5506646

CCCCNC(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.75
ALOX12 P18054 1/20 0.75
HDAC3 O15379 2/20 0.74
HDAC1 Q13547 2/20 0.74
HDAC2 Q92769 2/20 0.74
HDAC4 P56524 1/20 0.64
HDAC7 Q8WUI4 1/20 0.64
HDAC10 Q969S8 1/20 0.64
HDAC11 Q96DB2 1/20 0.64
HDAC8 Q9BY41 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
HDAC9 Q9UKV0 1/20 0.64
HDAC5 Q9UQL6 1/20 0.64
MGLL Q99685 2/20 0.63
SMN1; SMN2 Q16637 5/20 0.61
RAB9A P51151 3/20 0.61
KMT2A Q03164 3/20 0.61
NPC1 O15118 2/20 0.61
MEN1 O00255 2/20 0.61
TAAR1 Q96RJ0 1/20 0.61

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
SCHEMBL5507892 0.95 MAPT (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL9507460 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11617043 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11610572 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL5694358 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11615321 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11617021 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11615696 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11614664 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2
SCHEMBL11048249 0.94 HDAC1 (0.69) MAPTALOX12HDAC3HDAC1HDAC2

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 118 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115594603-A Method for preparing N-tert-butyl-4-aminobenzamide by using microchannel reactor 湖北师范大学(CN) 2023-01-13 CN claimed
EP-1332363-A4 DETECTION OF NEURODEGENERATIVE DISORDERS DOUBLE KAY (AU) 2007-08-29 EP claimed
US-7005546-B2 Acetamidobenzamide compounds for neurodegenerative disorders RENOVIS, INC. (US) 2006-02-28 US claimed
US-20050260577-A1 Detection of neurodegenerative disorders POWMRI LIMITED (AU) 2005-11-24 US claimed
EP-1581202-A2 METHODS FOR THE TREATMENT OF PAIN AND TRAUMATIC INJURY USING BENZAMIDES AND COMPOSITIONS CONTAINING THE SAME Renovis, Inc. (US) 2005-10-05 EP claimed
US-20040167226-A1 Methods for the treatment of pain and traumatic injury using benzamides and compositions containing the same RENOVIS, INC. 2004-08-26 US claimed
WO-2004060286-A2 METHODS FOR THE TREATMENT OF PAIN AND TRAUMATIC INJURY USING BENZAMIDES AND COMPOSITIONS CONTAINING THE SAME RENOVIS, INC. (US) 2004-07-22 WO claimed
EP-1332363-A1 DETECTION OF NEURODEGENERATIVE DISORDERS UNISEARCH LIMITED (AU) 2003-08-06 EP claimed
WO-2002031499-A1 DETECTION OF NEURODEGENERATIVE DISORDERS UNISEARCH LIMITED (AU) 2002-04-18 WO claimed
CN-1073552-C Benzamides for neurodegenerative disorder treatment CENTAUR PHARMACEUTICALS INC (US) 2001-10-24 CN claimed
EP-0819113-B1 BENZAMIDES FOR NEURODEGENERATIVE DISORDER TREATMENT CENTAUR PHARMACEUTICALS INC (US) 2001-06-27 EP claimed
EP-1079820-A1 BENZAMIDE THERAPEUTICS FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASE CENTAUR PHARMACEUTICALS, INC. (US) 2001-03-07 EP claimed
US-6194465-B1 ADMINISTERING ACETAMIDO-, NITRO-, OR AMINO-MONO- OR DISUBSTITUTED N-ALKYL BENZAMIDE COMPOUNDS SUCH AS N-TERT-BUTYL-4-ACETAMIDOBENZAMIDE FOR PROPHLAXIS OR TREATMENT OF AN INFLAMMATORY BOWEL CONDITION IN A PATIENT CENTAUR PHARMACEUTICALS, INC. 2001-02-27 US claimed
WO-1999059569-A1 BENZAMIDE THERAPEUTICS FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASE CENTAUR PHARMACEUTICALS, INC. (US) 1999-11-25 WO claimed
CN-1182416-A Benzamides for neurodegenerative disorder treatment CENTAUR PHARMACUETICALS INC (US) 1998-05-20 CN claimed
EP-0819113-A1 BENZAMIDES FOR NEURODEGENERATIVE DISORDER TREATMENT CENTAUR PHARMACEUTICALS, INC. (US) 1998-01-21 EP claimed
WO-1996031462-A1 BENZAMIDES FOR NEURODEGENERATIVE DISORDER TREATMENT CENTAUR PHARMACEUTICALS, INC. (US) 1996-10-10 WO claimed
EP-0345551-B1 EASILY FLOWABLE DELAYED CRYSTALLISING POLYARYLENE SULFIDE-MIXTURES BAYER AG (DE) 1993-09-08 EP claimed
EP-4345091-A1 BENZOIC ACID DERIVATIVES, METHODS AND USES THEREOF Faculdade de Farmácia da Universidade de Lisboa (PT) 2024-04-03 EP disclosed
US-4097489-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-06-27 US 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-20040167226-A1 Methods for the treatment of pain and traumatic injury using benzamides and compositions containing the same CNR1, NAA50, CNR2 MAPT 2635/4885ALOX12 1520/4885HDAC3 13/4885

“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.