SCHEMBL5700307

SCHEMBL5700307

NC(=O)c1ccncc1I

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.57
SIRT3 Q9NTG7 2/20 0.57
KDM4E B2RXH2 3/20 0.48
KDM4C Q9H3R0 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
KDM6B O15054 1/20 0.48
KDM4A O75164 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4D Q6B0I6 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HTT P42858 1/20 0.46
F7 P08709 1/20 0.45
F3 P13726 1/20 0.45
SARM1 Q6SZW1 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.45
SIRT6 Q8N6T7 1/20 0.45
SIRT1 Q96EB6 1/20 0.45

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
SCHEMBL15550884 0.85 SIRT3 (0.60) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL1687197 0.82 TDP1 (0.67) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL1330970 0.82 TDP1 (0.67) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL1023235 0.80 KDM4C (0.61) TDP1KDM4EKDM4CALDH1A1MEN1
Hydrochloric Acid SCHEMBL4259779 0.78 KDM4C (0.59) TDP1KDM4EKDM4CALDH1A1MEN1
SCHEMBL2139056 0.78 KDM4E (0.70) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL2645252 0.78 TDP1 (0.57) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL2645253 0.78 TDP1 (0.57) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL16414446 0.78 KDM4C (0.44) TDP1SIRT3KDM4EKDM4CALDH1A1
SCHEMBL11870062 0.77 KDM4C (0.62) TDP1SIRT3KDM4EKDM4CALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250296915-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2025-09-25 US disclosed
EP-1270582-B1 TRIPHENYLPHOSPHINE DERIVATIVES, PALLADIUM OR NICKEL COMPLEXES THEREOF, AND PROCESS FOR PREPARING BIARYL DERIVATIVES MITSUBISHI RAYON CO (JP) 2006-08-30 EP disclosed
US-6693210-B2 USING PALLADIUM, NICKEL PHOSPHINE COMPLEX AS CATALYSTS MITSUBISHI RAYON CO., LTD. (JP) 2004-02-17 US disclosed
US-20030065208-A1 Using palladium, nickel phosphine complex as catalysts MITSUBISHI RAYON CO., LTD. (JP) 2003-04-03 US disclosed
EP-1270582-A1 TRIPHENYLPHOSPHINE DERIVATIVE, PRODUCTION PROCESS THEREFOR, PALLADIUM COMPLEX THEREOF, AND PROCESS FOR PRODUCING BIARYL DERIVATIVE Mitsubishi Rayon Co., Ltd. (JP) 2003-01-02 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 (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-20250296915-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP TDP1 3976/4885SIRT3 3851/4885KDM4E 4163/4885
US-20030065208-A1 Using palladium, nickel phosphine complex as catalysts PDCD1LG2, PIK3CA, PDCD1 TDP1 4088/4885SIRT3 1556/4885KDM4E 2983/4885

“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.