SCHEMBL6174882

SCHEMBL6174882

Nc1nc(-c2ccc(NC(=O)CN(C(=O)c3ccc(F)cc3)c3ccc4c(c3)OCCO4)cc2)cs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.49
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ MAPT P10636 9/20 0.47
▸ ALDH1A1 P00352 6/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ GAA P10253 4/20 0.46
▸ LMNA P02545 4/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ USP2 O75604 1/20 0.46
▸ RAB9A P51151 6/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ TP53 P04637 2/20 0.45
▸ MAOB P27338 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42

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
SCHEMBL6172214 0.95 MAPT (0.51) POLBMEN1KMT2AL3MBTL1MAPT
Hydrochloric Acid SCHEMBL6173338 0.87 RAB9A (0.50) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL6174603 0.85 MAPT (0.53) POLBMEN1KMT2AMAPTALDH1A1
Hydrochloric Acid SCHEMBL6175614 0.84 MAPT (0.49) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL27583802 0.84 KMT2A (0.48) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL6173268 0.84 RAB9A (0.43) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL6176759 0.84 RAB9A (0.57) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL27601320 0.83 MEN1 (0.48) POLBMEN1KMT2AMAPTALDH1A1
Hydrochloric Acid SCHEMBL6174792 0.83 MEN1 (0.48) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL27601474 0.82 KMT2A (0.41) POLBMEN1KMT2AMAPTALDH1A1

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
US-6949543-B2 Amide derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-27 — — US claimed
EP-1340750-B1 AMIDE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-08-17 — — EP claimed
US-20040034232-A1 Amide derivative ASTELLAS PHARMA INC. (JP) 2004-02-19 — — US claimed
EP-1340750-A1 AMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-09-03 — — EP claimed
US-6949543-B2 Amide derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-27 — — US disclosed
EP-1340750-B1 AMIDE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-08-17 — — EP disclosed
US-20040034232-A1 Amide derivative ASTELLAS PHARMA INC. (JP) 2004-02-19 — — US disclosed
EP-1340750-A1 AMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-09-03 — — EP 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-20040034232-A1 Amide derivative HDAC2, ZC3HAV1, HDAC4 POLB 3218/4885MEN1 4073/4885KMT2A 111/4885

“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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