SCHEMBL3185463

SCHEMBL3185463

ONc1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
HPGD P15428 5/20 0.59
KDM4E B2RXH2 4/20 0.59
MAPT P10636 1/20 0.59
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HSD17B10 Q99714 4/20 0.48
CYP3A4 P08684 2/20 0.48
TSHR P16473 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP1A2 P05177 4/20 0.48
CYP1A1 P04798 2/20 0.48
CYP1B1 Q16678 2/20 0.48
ERBB2 P04626 1/20 0.45
FYN P06241 1/20 0.45
MAOA P21397 1/20 0.45
ACHE P22303 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
SCHEMBL29386227 1.00 ALDH1A1 (0.59) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL2837800 0.82 ALDH1A1 (0.58) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL10421497 0.78 ALDH1A1 (0.55) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL31683709 0.78 ALDH1A1 (0.59) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL1147227 0.78 ALDH1A1 (0.55) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL2317725 0.78 ALDH1A1 (0.59) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL8926018 0.78 ALDH1A1 (0.55) ALDH1A1HPGDKDM4EMAPTHDAC1
Iodide SCHEMBL17782948 0.77 ALDH1A1 (0.58) ALDH1A1HPGDKDM4EMAPTHDAC1
Hydrochloric Acid SCHEMBL29019525 0.77 ALDH1A1 (0.58) ALDH1A1HPGDKDM4EMAPTHDAC1
Hydrochloric Acid SCHEMBL4578334 0.77 ALDH1A1 (0.58) ALDH1A1HPGDKDM4EMAPTHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230273193-A1 SENSOR DEVICE, REAGENT FOR MODIFYING SURFACE OF SENSOR ELEMENT, METHOD OF MODIFYING SURFACE OF SENSOR ELEMENT AND METHOD OF MANUFACTURING SENSOR DEVICE KABUSHIKI KAISHA TOSHIBA (JP) 2023-08-31 US disclosed
US-7667048-B2 Green and orange fluorescent labels and their uses ARIES ASSOCIATES, INC. (US) 2010-02-23 US disclosed
US-20080261235-A1 Novel Green and Orange Fluorescent Labels and Their Uses BHATT RAM 2008-10-23 US disclosed
US-7317111-B2 Green and orange fluorescent labels and their uses ARIES ASSOCIATES, INC. (US) 2008-01-08 US disclosed
EP-1546673-A4 NOVEL GREEN AND ORANGE FLUORESCENT LABELS AND THEIR USES CHROMAGEN INC (US) 2006-08-09 EP disclosed
EP-1546673-A2 NOVEL GREEN AND ORANGE FLUORESCENT LABELS AND THEIR USES CHROMAGEN, INC. (US) 2005-06-29 EP disclosed
US-20040106806-A1 Novel green and orange fluorescent labels and their uses ARIES ASSOCIATES, INC. 2004-06-03 US disclosed
WO-2004027388-A2 NOVEL GREEN AND ORANGE FLUORESCENT LABELS AND THEIR USES CHROMAGEN, INC. (US) 2004-04-01 WO 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-20040106806-A1 Novel green and orange fluorescent labels and their uses CD69, ANXA5, ANXA6 ALDH1A1 2125/4885HPGD 2839/4885KDM4E 3408/4885
US-20080261235-A1 Novel Green and Orange Fluorescent Labels and Their Uses CD69, ANXA6, ANXA5 ALDH1A1 1993/4885HPGD 2296/4885KDM4E 3665/4885

“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.