SCHEMBL6136970

SCHEMBL6136970

CN(C(=O)CCNC(=O)c1ccc(-n2nc(-c3ccc(C(N)=O)cc3)c3ccccc32)cc1)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
DGAT2 Q96PD7 9/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ATM Q13315 1/20 0.37
CHRM4 P08173 1/20 0.37
GCGR P47871 1/20 0.36
HPGDS O60760 1/20 0.36
F2RL3 Q96RI0 1/20 0.35
SCN9A Q15858 1/20 0.35

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
SCHEMBL6136968 0.84 SMN1; SMN2 (0.48) HPGDL3MBTL1MEN1KMT2ANPSR1
SCHEMBL6137351 0.77 RORC (0.50) HPGDF2RL3SCN9A
SCHEMBL6354434 0.74 DGAT2 (0.40) HPGDL3MBTL1MEN1KMT2ANPSR1
SCHEMBL6136810 0.73 ALDH1A1 (0.54) HPGDMEN1KMT2AF2RL3SCN9A
SCHEMBL6139715 0.73 MEN1 (0.43) HPGDL3MBTL1MEN1KMT2ANPSR1
SCHEMBL6137028 0.73 RORC (0.59) HPGDSCN9A
SCHEMBL6136923 0.72 MAPK8 (0.55) HPGDL3MBTL1MEN1KMT2ANPSR1
SCHEMBL6136872 0.72 RORC (0.47) HPGDL3MBTL1MEN1KMT2ANPSR1
SCHEMBL6136884 0.67 RORC (0.66) HPGD
SCHEMBL6363756 0.66 DGAT2 (0.41) HPGDL3MBTL1MEN1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050227299-A1 Fluorescent dyes (AIDA) for solid phase and solution phase screening AUER MANFRED 2005-10-13 US disclosed
EP-1140856-B1 FLUORESCENT DYES FOR SOLID PHASE AND SOLUTION PHASE SCREENING NOVARTIS AG (CH) 2005-04-27 EP disclosed
EP-1140856-A1 FLUORESCENT DYES FOR SOLID PHASE AND SOLUTION PHASE SCREENING Novartis AG (CH) 2001-10-10 EP disclosed
US-20010005752-A1 Fluorescent dyes (AIDA) for solid phase and solution phase screening AUER MANFRED (AT) 2001-06-28 US disclosed
US-6207831-B1 A BENZOPYRAZOLE COMPOUND NOVARTIS AG (CH) 2001-03-27 US disclosed
WO-2000037448-A1 FLUORESCENT DYES FOR SOLID PHASE AND SOLUTION PHASE SCREENING NOVARTIS AG (CH) 2000-06-29 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-20010005752-A1 Fluorescent dyes (AIDA) for solid phase and solution phase screening SLC43A1, CUTA, ANXA1 HPGD 4341/4885L3MBTL1 1660/4885MEN1 2066/4885
US-20050227299-A1 Fluorescent dyes (AIDA) for solid phase and solution phase screening SLCO1A2, ABCG2, SLCO1B1 HPGD 2745/4885L3MBTL1 3846/4885MEN1 2470/4885

“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.