SCHEMBL3205682

SCHEMBL3205682

CC(C)(C)C(=O)Nc1cccc([N+](=O)[O-])c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.69
KMT2A Q03164 12/20 0.69
MEN1 O00255 11/20 0.69
MAPT P10636 8/20 0.69
HTT P42858 5/20 0.69
POLB P06746 4/20 0.69
DDX3X O00571 2/20 0.69
CTDSP1 Q9GZU7 1/20 0.69
ALDH1A1 P00352 5/20 0.64
NPC1 O15118 1/20 0.64
LMNA P02545 1/20 0.64
NFKB1 P19838 1/20 0.64
RAB9A P51151 1/20 0.64
NFKB2 Q00653 1/20 0.64
RELA Q04206 1/20 0.64
BLM P54132 1/20 0.61
MAPK1 P28482 3/20 0.58
HPGD P15428 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
HSP90AA1 P07900 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
SCHEMBL13488638 0.89 SMN1; SMN2 (0.68) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL14267699 0.84 KMT2A (0.69) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL3088486 0.83 MEN1 (0.60) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL1936849 0.83 SMN1; SMN2 (0.59) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL11095310 0.82 ALDH1A1 (0.63) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL1248559 0.82 SMN1; SMN2 (1.00) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL1047211 0.82 MEN1 (1.00) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL11735282 0.81 SMN1; SMN2 (0.61) SMN1; SMN2KMT2AMEN1MAPTHTT
SCHEMBL16722802 0.81 NPSR1 (0.76) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL3222110 0.81 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AMEN1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-05-09 US disclosed
US-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-05-09 US disclosed
US-20200407328-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2020-12-31 US disclosed
US-20200407328-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2020-12-31 US disclosed
US-10738016-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-08-11 US disclosed
US-10738016-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-08-11 US disclosed
US-20190055203-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2019-02-21 US disclosed
US-20190055203-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2019-02-21 US disclosed
US-10106507-B2 Potent dual BRD4-kinase inhibitors as cancer therapeutics H. Lee Moffitt Cancer Center and Research Insitute, Inc. (US) 2018-10-23 US disclosed
US-20180290984-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2018-10-11 US disclosed
US-20170226065-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2017-08-10 US disclosed
US-20170226065-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2017-08-10 US disclosed
WO-2017066428-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE, INC. (US) 2017-04-20 WO disclosed
WO-2017066428-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE, INC. (US) 2017-04-20 WO disclosed
US-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG SCHULZE KLAUSE 2010-02-25 US disclosed
US-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG SCHULZE KLAUSE 2010-02-25 US disclosed
US-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG SCHULZE KLAUSE 2010-02-25 US disclosed
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 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 (9 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-20200407328-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS BRD4, BICRA, BRDT SMN1; SMN2 4754/4885KMT2A 664/4885MEN1 4277/4885
US-10738016-B2 BRD4-kinase inhibitors as cancer therapeutics BRD4, BICRA, BRDT SMN1; SMN2 4754/4885KMT2A 664/4885MEN1 4277/4885
US-20100048891-A1 METASUBSTITUTED THIAZOLIDINONES, THEIR MANUFACTURE AND USE AS A DRUG PLK2, PDXK, PLK4 SMN1; SMN2 2774/4885KMT2A 3012/4885MEN1 3222/4885
US-20180290984-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS BRD4, BICRA, BRDT SMN1; SMN2 4754/4885KMT2A 664/4885MEN1 4277/4885
US-10106507-B2 Potent dual BRD4-kinase inhibitors as cancer therapeutics BRD4, BICRA, BRDT SMN1; SMN2 4058/4885KMT2A 305/4885MEN1 3996/4885
US-20190055203-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS BRD4, BICRA, BRDT SMN1; SMN2 4058/4885KMT2A 305/4885MEN1 3996/4885
US-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics BRD4, BICRA, BRDT SMN1; SMN2 4754/4885KMT2A 664/4885MEN1 4277/4885
US-20170226065-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS BRD4, BICRA, BRDT SMN1; SMN2 4058/4885KMT2A 305/4885MEN1 3996/4885
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug PLK4, PDXK, PLK2 SMN1; SMN2 3196/4885KMT2A 2543/4885MEN1 3023/4885

“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.