SCHEMBL5032272

SCHEMBL5032272

COc1ccc(N(c2nc(N)nc(NC3CCCCCC3)n2)C2CCN(C)CC2)cc1F

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.48
EHMT2 Q96KQ7 7/20 0.44
EHMT1 Q9H9B1 5/20 0.44
HRH4 Q9H3N8 2/20 0.40
BCL6 P41182 2/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
AGER Q15109 1/20 0.38
AURKA O14965 1/20 0.38
AURKB Q96GD4 1/20 0.38
CCR4 P51679 2/20 0.37

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
SCHEMBL6818739 0.96 SMN1; SMN2 (0.46) SMN1; SMN2EHMT2EHMT1HRH4BCL6
SCHEMBL6233712 0.88 ALDH1A1 (0.39) EHMT2EHMT1HRH4BCL6KDM4E
SCHEMBL5438494 0.88 SMN1; SMN2 (0.45) SMN1; SMN2BCL6KDM4EALDH1A1LMNA
SCHEMBL6237774 0.85 EHMT2 (0.45) EHMT2EHMT1HRH4KDM4EALDH1A1
SCHEMBL5457407 0.82 EHMT2 (0.53) SMN1; SMN2EHMT2EHMT1BCL6KDM4E
SCHEMBL4837987 0.81 EHMT2 (0.50) SMN1; SMN2EHMT2EHMT1BCL6KDM4E
SCHEMBL6856412 0.81 SPIN1 (0.40) SMN1; SMN2EHMT2KDM4EALDH1A1LMNA
SCHEMBL5556209 0.81 SMN1; SMN2 (0.52) SMN1; SMN2EHMT2EHMT1BCL6KDM4E
SCHEMBL5420949 0.80 EHMT2 (0.36) EHMT2EHMT1HRH4BCL6KDM4E
SCHEMBL4841050 0.77 SMN1; SMN2 (0.39) SMN1; SMN2BCL6KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7335656-B2 Stent with a disposed traiazine compound such as 6-(3-Chloro-4-methoxy-phenoxy)-N-cycloheptyl-N'-methyl-N'-(1-methyl-piperidin-4-yl)-[1,3,5]triazine-2,4-diamine for inhibiting smooth muscle proliferation; restenosis and atherosclerosis REDDY US THERAPEUTICS, INC. (US) 2008-02-26 US claimed
US-20070122444-A1 Medical devices employing triazine compounds and compositions thereof DR. REDDY'S LABORATORIES LTD. (IN) 2007-05-31 US claimed

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-20070122444-A1 Medical devices employing triazine compounds and compositions thereof AREG, TGFB1, TGFB2 SMN1; SMN2 3890/4885EHMT2 2566/4885EHMT1 2678/4885

“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.