SCHEMBL6373302

SCHEMBL6373302

CC(=O)Nc1ccc(/C=c2\[nH]c(=O)/c(=C/c3ccc(N(C)C)cc3)[nH]c2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ MAPT P10636 5/20 0.45
▸ POLB P06746 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ RECQL P46063 1/20 0.45
▸ TNIK Q9UKE5 1/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ GAA P10253 2/20 0.44
▸ NR4A1 P22736 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ SERPINE1 P05121 3/20 0.42
▸ LRRK2 Q5S007 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ METAP1 P53582 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL6373310 1.00 KMT2A (0.45) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL6376088 0.85 SERPINE1 (0.56) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL6376092 0.85 SERPINE1 (0.56) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL8592216 0.84 METAP1 (0.54) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8592220 0.84 METAP1 (0.54) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL6374734 0.83 LRRK2 (0.55) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL8596135 0.83 KMT2A (0.53) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL6374742 0.83 LRRK2 (0.55) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL8596133 0.83 KMT2A (0.53) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL8593046 0.81 SERPINE1 (0.63) KMT2AMEN1MAPTALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0655060-B1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LTD (GB) 1998-01-14 — — EP claimed
EP-0655060-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1995-05-31 — — EP claimed
WO-1994004512-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1994-03-03 — — WO claimed
US-20050249681-A1 Use of diketopiperazine derivatives as photostable uv-filters in cosmetic and pharmaceutical preparations BASF AKTIENGESELLSCHAFT (DE) 2005-11-10 — — US disclosed
EP-0655060-B1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LTD (GB) 1998-01-14 — — EP disclosed
US-5700804-A INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITORS XENOVA LIMITED (GB) 1997-12-23 — — US disclosed
EP-0655060-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1995-05-31 — — EP disclosed
WO-1994004512-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1994-03-03 — — 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 (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-20050249681-A1 Use of diketopiperazine derivatives as photostable uv-filters in cosmetic and pharmaceutical preparations DHPS, MC1R, MITF KMT2A 2491/4885MEN1 2606/4885MAPT 820/4885

“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.

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