SCHEMBL1891276

SCHEMBL1891276

CCOC(=O)c1ccncc1NC(=O)Cc1c(F)cc(F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.44
▸ KDM4C Q9H3R0 2/20 0.44
▸ KDM6B O15054 1/20 0.44
▸ KDM4D Q6B0I6 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ KDM4E B2RXH2 4/20 0.41
▸ LMNA P02545 2/20 0.41
▸ KDM5A P29375 1/20 0.41
▸ KDM5B Q9UGL1 1/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ NAMPT P43490 1/20 0.41
▸ TSHR P16473 4/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ HTT P42858 2/20 0.40

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
SCHEMBL4166313 0.85 SMN1; SMN2 (0.41) TP53L3MBTL1MAPTSMN1; SMN2POLB
SCHEMBL1169069 0.85 KDM4C (0.47) TP53KDM4CKDM6BKDM4DL3MBTL1
SCHEMBL4715967 0.80 BRD4 (0.44) L3MBTL1MAPTSMN1; SMN2POLBKDM4E
SCHEMBL4153764 0.80 MAPT (0.41) L3MBTL1MAPTSMN1; SMN2POLBTDP1
SCHEMBL4161486 0.78 BRD4 (0.46) TP53L3MBTL1MAPTSMN1; SMN2POLB
SCHEMBL12660312 0.78 BRD4 (0.68) TP53L3MBTL1MAPTSMN1; SMN2POLB
SCHEMBL4716111 0.78 NTRK1 (0.45) L3MBTL1MAPTSMN1; SMN2POLBTDP1
SCHEMBL1887669 0.78 HTT (0.57) TP53L3MBTL1MAPTSMN1; SMN2POLB
SCHEMBL15286826 0.77 KDM4C (0.70) TP53KDM4CKDM6BKDM4DL3MBTL1
SCHEMBL15295150 0.77 TP53 (0.54) TP53KDM4CKDM6BMAPTSMN1; SMN2

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-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 — — US disclosed
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 — — US disclosed
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 — — US disclosed
EP-1585746-B1 NAPHTHYRIDINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA LTD (GB) 2007-01-31 — — EP disclosed
US-20060069089-A1 Fungicides SYNGENTA CROP PROTECTION, INC. 2006-03-30 — — US disclosed
EP-1585746-A2 NAPHTHYRIDINE DERIVATIVES AND THEIR USE AS FUNGICIDES Syngenta Limited (GB) 2005-10-19 — — EP disclosed
WO-2004056824-A2 NAPHTHYRIDINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA LIMITED (GB) 2004-07-08 — — 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-20060069089-A1 Fungicides CBR3, TACR3, HCRTR1 TP53 4540/4885KDM4C 477/4885KDM6B 1361/4885

“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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