SCHEMBL25898426

SCHEMBL25898426

CN(C)Cc1cc(CCC(C)(c2cc(CN(C)C)c(O)c(CN(C)C)c2)c2cc(CN(C)C)c(O)c(CN(C)C)c2)cc(CN(C)C)c1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 4/20 0.62
ALOX15 P16050 2/20 0.62
MAPK1 P28482 1/20 0.62
HTT P42858 1/20 0.62
HSD17B10 Q99714 5/20 0.49
CYP2C9 P11712 4/20 0.49
CYP2D6 P10635 5/20 0.46
TSHR P16473 5/20 0.46
ALDH1A1 P00352 5/20 0.44
GAA P10253 3/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 4/20 0.41
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
G6PD P11413 1/20 0.40
PABPC1 P11940 1/20 0.40
KMT2A Q03164 1/20 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
SCHEMBL25898430 0.94 CYP2C19 (0.55) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL25898427 0.91 CYP2C19 (0.51) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL25898431 0.85 CYP2D6 (0.49) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL25898433 0.82 CYP2D6 (0.46) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL25898408 0.81 SHBG (0.42) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL25898411 0.77 PRKCE (0.39) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL6057620 0.77 ALOX15 (1.00) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL7117673 0.77 CYP2C19 (1.00) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL13090360 0.77 CYP2C19 (0.78) CYP2C19ALOX15MAPK1HTTHSD17B10
SCHEMBL25898410 0.76 SHBG (0.53) CYP2C19ALOX15MAPK1HTTHSD17B10

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-20230234905-A1 NOVEL TRISPHENOL DERIVATIVE HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2023-07-27 US disclosed
US-20230234905-A1 NOVEL TRISPHENOL DERIVATIVE HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2023-07-27 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-20230234905-A1 NOVEL TRISPHENOL DERIVATIVE TTPA, CDK2AP2, CDKL2 CYP2C19 1012/4885ALOX15 3289/4885MAPK1 3857/4885

“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.