Sugi Predict

Sugi Predict / Compounds / SCHEMBL10000752

SCHEMBL10000752

SCHEMBL10000752

C/C=C/c1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.47
▸ LMNA P02545 5/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ NPC1 O15118 4/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ MAPT P10636 2/20 0.37
▸ TRPV1 Q8NER1 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GRIN2D O15399 2/20 0.36
▸ GRIN3B O60391 2/20 0.36
▸ GRIN1 Q05586 2/20 0.36
▸ GRIN2A Q12879 2/20 0.36
▸ GRIN2B Q13224 2/20 0.36
▸ GRIN2C Q14957 2/20 0.36

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
SCHEMBL15681222 0.90 CYP1A2 (0.52) CYP1A2LMNAALDH1A1TSHRKDM4E
SCHEMBL13636758 0.90 CYP1A2 (0.52) CYP1A2LMNAALDH1A1TSHRKDM4E
SCHEMBL12887521 0.90 CYP1A2 (0.52) CYP1A2LMNAALDH1A1TSHRKDM4E
SCHEMBL868821 0.88 CYP1A2 (0.57) CYP1A2LMNAALDH1A1TSHRKDM4E
SCHEMBL868822 0.88 CYP1A2 (0.57) CYP1A2LMNAALDH1A1TSHRKDM4E
SCHEMBL13978791 0.85 ALDH1A1 (0.50) LMNAALDH1A1TSHRKDM4ETP53
SCHEMBL13358460 0.85 CYP1A2 (0.47) CYP1A2ALDH1A1TSHRNPC1RAB9A
SCHEMBL10299915 0.85 CYP1A2 (0.47) CYP1A2ALDH1A1TSHRNPC1RAB9A
SCHEMBL23430058 0.83 RELA (0.50) CYP1A2LMNAALDH1A1KDM4ECYP3A4
SCHEMBL13636796 0.83 TSHR (0.56) CYP1A2TSHRNPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759521-B2 Panchromatic photosensitizers and dye-sensitized solar cell using the same NATIONAL TSING HUA UNIVERSITY (TW) 2014-06-24 — — US disclosed
US-8759521-B2 Panchromatic photosensitizers and dye-sensitized solar cell using the same NATIONAL TSING HUA UNIVERSITY (TW) 2014-06-24 — — US disclosed
US-20120111410-A1 PANCHROMATIC PHOTOSENSITIZERS AND DYE-SENSITIZED SOLAR CELL USING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2012-05-10 — — US disclosed
US-20120111410-A1 PANCHROMATIC PHOTOSENSITIZERS AND DYE-SENSITIZED SOLAR CELL USING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2012-05-10 — — US disclosed
US-20100258175-A1 PANCHROMATIC PHOTOSENSITIZERS AND DYE-SENSITIZED SOLAR CELL USING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2010-10-14 — — US disclosed
US-20100258175-A1 PANCHROMATIC PHOTOSENSITIZERS AND DYE-SENSITIZED SOLAR CELL USING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2010-10-14 — — 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 (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-20120111410-A1 PANCHROMATIC PHOTOSENSITIZERS AND DYE-SENSITIZED SOLAR CELL USING THE SAME MLX, PRXL2A, MSL1 CYP1A2 3093/4885LMNA 2415/4885ALDH1A1 885/4885
US-20100258175-A1 PANCHROMATIC PHOTOSENSITIZERS AND DYE-SENSITIZED SOLAR CELL USING THE SAME MLX, PRXL2A, MSL1 CYP1A2 3126/4885LMNA 2916/4885ALDH1A1 973/4885

“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.