SCHEMBL6077148

SCHEMBL6077148

ClCCCON=Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
NPFFR2 Q9Y5X5 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 2/20 0.40
G6PC1 P35575 1/20 0.40
ALDH1A1 P00352 1/20 0.39
UNG P13051 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 1/20 0.38
THRB P10828 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PYGL P06737 8/20 0.38
LMNA P02545 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
SCHEMBL6077672 0.77 L3MBTL1 (0.43) KMT2AL3MBTL1MEN1MAPTTDP1
SCHEMBL6076759 0.76 ALDH1A1 (0.51) L3MBTL1ALDH1A1MAPTTDP1NPC1
SCHEMBL6873224 0.73 G6PC1 (0.56) KMT2ANPFFR2NPSR1L3MBTL1MEN1
SCHEMBL12757027 0.72 SRC (0.56) KMT2ANPFFR2NPSR1MEN1G6PC1
SCHEMBL7237460 0.67 KDM4E (0.61) KMT2AL3MBTL1MEN1ALDH1A1SMN1; SMN2
SCHEMBL6865973 0.67 GPR55 (0.41) KMT2ANPFFR2NPSR1MEN1ALDH1A1
SCHEMBL6865977 0.67 GPR55 (0.41) KMT2ANPFFR2NPSR1MEN1ALDH1A1
SCHEMBL8462042 0.67 NPFFR2 (0.60) KMT2ANPFFR2NPSR1MEN1G6PC1
SCHEMBL6877540 0.66 PLA2G7 (0.41) KMT2AL3MBTL1MEN1MAPTTDP1
SCHEMBL2164853 0.65 KMT2A (0.58) KMT2ANPFFR2NPSR1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109186-B2 4-hydroxy-5-oxo-1-(2-[4-methylpiperazin-1-yl]ethyl)-2,5-dihydro-1H-pyrrole-3-carboxylic acid (3,4-dichlorobenzyl)-methyl-amide for human immunodeficiency virus (HIV) treatment BRISTOL-MYERS SQUIBB COMPANY (US) 2006-09-19 US disclosed
US-20040110804-A1 HIV integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-06-10 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-20040110804-A1 HIV integrase inhibitors CDKN1A, SAMHD1, CTCF KMT2A 736/4885NPFFR2 4665/4885NPSR1 4603/4885

“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.