SCHEMBL7079281

SCHEMBL7079281

Cc1ccc(C(=O)NCCCn2ccnc2)c(Nc2ccc3cn[nH]c3c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
CYP19A1 P11511 1/20 0.51
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 3/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
HTT P42858 1/20 0.46
QPCT Q16769 1/20 0.45
LMNA P02545 1/20 0.45
THRB P10828 1/20 0.45
NAMPT P43490 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 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
SCHEMBL6772485 0.87 HSD17B10 (0.46) ALDH1A1CYP19A1KMT2AMEN1HSD17B10
SCHEMBL7764656 0.84 ALDH1A1 (0.48) ALDH1A1CYP19A1KMT2AMEN1HSD17B10
SCHEMBL7081409 0.83 SYK (0.46) ALDH1A1KMT2AKDM4EHPGDATM
SCHEMBL7081591 0.81 SYK (0.43) ALDH1A1KDM4EHPGDLMNACYP1A2
SCHEMBL6769445 0.80 HSD17B10 (0.46) ALDH1A1CYP19A1KMT2AMEN1HSD17B10
SCHEMBL7083122 0.80 RPS6KB1 (0.49) KDM4EHPGDHTTLMNANPC1
SCHEMBL7078467 0.80 PDGFRB (0.56) ALDH1A1KMT2AMEN1HSD17B10LMNA
SCHEMBL7077905 0.79 PDGFRB (0.67) ALDH1A1KMT2AHSD17B10KDM4ELMNA
SCHEMBL7081452 0.77 SYK (0.50) ALDH1A1KMT2AHSD17B10KDM4EHPGD
SCHEMBL7077388 0.77 ALDH1A1 (0.48) ALDH1A1KMT2AHSD17B10KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6608058-B2 Therapeutic composition for hepatitis B, hepatitis C, or acquired immune deficiency syndrome DONG WHA PHARM. IND. CO., LTD. (KR) 2003-08-19 US claimed
US-20030092709-A1 6-Methylnicotinamide derivatives as antiviral agents DONG WHA PHARM. CO., LTD. (KR) 2003-05-15 US claimed
US-6608058-B2 Therapeutic composition for hepatitis B, hepatitis C, or acquired immune deficiency syndrome DONG WHA PHARM. IND. CO., LTD. (KR) 2003-08-19 US disclosed
US-20030092709-A1 6-Methylnicotinamide derivatives as antiviral agents DONG WHA PHARM. CO., LTD. (KR) 2003-05-15 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-20030092709-A1 6-Methylnicotinamide derivatives as antiviral agents TPMT, HAVCR2, NNMT ALDH1A1 2651/4885CYP19A1 4142/4885KMT2A 486/4885

“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.