SCHEMBL2365151

SCHEMBL2365151

CCCCCN1N=C(C)CC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 1.00
GAA P10253 5/20 1.00
MAPT P10636 4/20 1.00
THRB P10828 2/20 1.00
TDP1 Q9NUW8 5/20 0.40
MAOA P21397 4/20 0.40
MAOB P27338 4/20 0.40
MGLL Q99685 4/20 0.39
FAAH O00519 3/20 0.39
KDM4E B2RXH2 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 3/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PTGS1 P23219 4/20 0.36
PTGS2 P35354 3/20 0.36
CYP1A2 P05177 1/20 0.36
CHRM2 P08172 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL9153141 0.98 GAA (0.96) ALDH1A1GAAMAPTTHRBTDP1
SCHEMBL4664754 0.94 GAA (0.89) ALDH1A1GAAMAPTTHRBTDP1
SCHEMBL15884557 0.85 ALDH1A1 (0.73) ALDH1A1GAAMAPTTHRBTDP1
SCHEMBL9069384 0.81 GAA (0.68) ALDH1A1GAAMAPTTHRBTDP1
SCHEMBL17817456 0.79 ALDH1A1 (0.65) ALDH1A1GAAMAPTTHRBMGLL
SCHEMBL3269226 0.79 ALDH1A1 (0.65) ALDH1A1GAAMAPTTHRBMGLL
SCHEMBL310102 0.78
SCHEMBL28979898 0.78 GAA (0.64) ALDH1A1GAAMAPTTHRBMGLL
SCHEMBL10883416 0.76 MAPT (0.61) ALDH1A1GAAMAPTTHRBMGLL
SCHEMBL11421981 0.76 ALDH1A1 (0.61) ALDH1A1GAAMAPTTHRBMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9005670-B2 Use of histone acetyltransferase inhibitors as novel anti-cancer therapies THE JOHNS HOPKINS UNIVERSITY (US) 2015-04-14 US disclosed
US-20130142887-A1 USE OF HISTONE ACETYLTRANSFERASE INHIBITORS AS NOVEL ANTI-CANCER THERAPIES THE JOHNS HOPKINS UNIVERSITY (US) 2013-06-06 US disclosed
WO-2011085039-A2 USE OF HISTONE ACETYLTRANSFERASE INHIBITORS AS NOVEL ANTI-CANCER THERAPIES THE JOHNS HOPKINS UNIVERSITY (US) 2011-07-14 WO disclosed
EP-1043365-B1 Polymerizable 1,2-dipyrazolylethenes as dyes for ophthalmic plastic lenses HOYA HEALTHCARE CORP (JP) 2006-10-18 EP disclosed
US-6310215-B1 EXCELLENT COPOLYMERIZABILITY AND UNDERGO NO ELUTION IN AN ORGANIC SOLVENT HOYA HEALTHCARE CORPORATION (JP) 2001-10-30 US disclosed
EP-1043365-A1 Polymerizable 1,2-dipyrazolylethenes as dyes for ophthalmic plastic lenses Hoya Healthcare Corporation (JP) 2000-10-11 EP disclosed
US-5063245-A Hormone inhibitors NOVA PHARMACEUTICAL CORPORATION (US) 1991-11-05 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-20130142887-A1 USE OF HISTONE ACETYLTRANSFERASE INHIBITORS AS NOVEL ANTI-CANCER THERAPIES EP300, HDAC1, KAT2A ALDH1A1 677/4885GAA 1800/4885MAPT 2346/4885

“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.