SCHEMBL6074073

SCHEMBL6074073

CNc1cc([N+](=O)[O-])ccc1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.69
LMNA P02545 3/20 0.69
MEN1 O00255 8/20 0.61
KMT2A Q03164 8/20 0.61
MAPT P10636 6/20 0.61
ALDH1A1 P00352 4/20 0.61
TDP1 Q9NUW8 1/20 0.60
POLB P06746 3/20 0.59
CRHBP P24387 2/20 0.59
CRHR2 Q13324 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
HPGD P15428 1/20 0.59
HTT P42858 4/20 0.58
MAPK1 P28482 2/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
BLM P54132 1/20 0.58
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57

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
SCHEMBL9509694 0.86 HTT (0.68) SMN1; SMN2LMNAKMT2AMAPTALDH1A1
SCHEMBL20302624 0.85 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL18549285 0.85 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL30311318 0.85 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL27976139 0.85 SMN1; SMN2 (0.68) SMN1; SMN2LMNAMEN1KMT2AMAPT
Bromide SCHEMBL20984828 0.83 SMN1; SMN2 (0.66) SMN1; SMN2LMNAMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL20984568 0.83 SMN1; SMN2 (0.66) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL24749990 0.82 HSPB1 (0.54) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL5226315 0.82 SMN1; SMN2 (0.64) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL24042269 0.82 MAPT (0.57) SMN1; SMN2LMNAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007139951-A9 METHOD FOR TREATING PROLIFERATIVE DISORDERS ASSOCIATED WITH PROTOONCOGENE PRODUCTS SYNTA PHARMACEUTICALS CORP (US) 2008-01-31 WO disclosed
WO-2007139951-A2 METHOD FOR TREATING PROLIFERATIVE DISORDERS ASSOCIATED WITH PROTOONCOGENE PRODUCTS SYNTA PHARMACEUTICALS CORP. (US) 2007-12-06 WO disclosed
CN-100335461-C Arylsulfonanilide ureas TULARIK INC (US) 2007-09-05 CN disclosed
US-7060718-B2 Arylsulfonanilide ureas AMGEN INC. (US) 2006-06-13 US disclosed
US-20030207864-A1 Arylsulfonanilide ureas TULARK INC. 2003-11-06 US disclosed
US-6630513-B1 Capable of lowering plasma cholesterol levels and inhibiting abnormal cell proliferation, such as in cervical adenocarcinoma TULARIX INC. 2003-10-07 US disclosed
US-6583165-B2 Anticarcinogenic, -inflammatory and -proliferative agents; viricides; bactericides; vascular restenosis, autoimmune diseases; psoriasis; anticolesterol and -lipemic agents TULARIK INC. 2003-06-24 US disclosed
EP-1115701-B1 ARYLSULFONANILIDE UREAS TULARIK INC (US) 2003-05-21 EP disclosed
EP-1285911-A2 Arylsulfonanilide ureas Tularik Inc. (US) 2003-02-26 EP disclosed
CN-1319088-A Arylsulfonylaniline urease TULARIK INC (US) 2001-10-24 CN disclosed
US-20010027211-A1 Arylsulfonanilide ureas TULARIK INC. 2001-10-04 US disclosed
EP-1115701-A1 ARYLSULFONANILIDE UREAS Tularik Inc. (US) 2001-07-18 EP disclosed
US-6214880-B1 LOWERING PLASMA CHOLESTEROL LEVELS AND INHIBITING ABNORMAL CELL PROLIFERATION WITH SAID COMPOUND; TREATMENT OF CANCER, PSORIASIS, VASCULAR RESTENOSIS, INFECTIONS, ATHEROSCLEROSIS AND HYPERCHOLESTEROLEMIA TULARIK INC. 2001-04-10 US disclosed
WO-2001012593-A1 ARYLSULFONANILIDE DERIVATIVES TULARIK INC. (US) 2001-02-22 WO disclosed
US-6153585-A FOR TREATING CANCER, PSORIASIS, VASCULAR RESTENOSIS, INFECTIONS, ATHEROSCLEROSIS AND HYPERCHOLESTEROLEMIA TULARIK INC. (US) 2000-11-28 US disclosed
WO-2000017159-A1 ARYLSULFONANILIDE UREAS TULARIK INC. (US) 2000-03-30 WO disclosed
US-5801170-A Heterocyclic biphenylylamides useful as 5HT1D antagonists SMITHKLINE BEECHAM PLC (GB) 1998-09-01 US disclosed
EP-0733048-A1 HETEROCYCLIC BIPHENYLYLAMIDES USEFUL AS 5HT1D ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-09-25 EP disclosed
WO-1995015954-A1 HETEROCYCLIC BIPHENYLYLAMIDES USEFUL AS 5HT1D ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-06-15 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 (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-20030207864-A1 Arylsulfonanilide ureas UTS2R, UACA, UMPS SMN1; SMN2 4664/4885LMNA 3161/4885MEN1 3494/4885
US-20010027211-A1 Arylsulfonanilide ureas UTS2R, UACA, UMPS SMN1; SMN2 4664/4885LMNA 3161/4885MEN1 3494/4885

“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.