SCHEMBL12964971

SCHEMBL12964971

Oc1cc(-n2c3ccccc3c3ccccc32)cc(O)c1C1C(O)C(c2c(O)cc(-n3c4ccccc4c4ccccc43)cc2O)C1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.46
▸ ATM Q13315 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ HDAC4 P56524 1/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ POLB P06746 3/20 0.34
▸ ALDH1A1 P00352 6/20 0.34
▸ KMT2A Q03164 6/20 0.34
▸ MEN1 O00255 5/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ BRCA1 P38398 1/20 0.34
▸ BACE1 P56817 2/20 0.33
▸ MAPT P10636 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL22246604 1.00 KDM4E (0.46) KDM4EATML3MBTL1HDAC4CYP1A2
SCHEMBL24513159 0.81 KDM4E (0.43) KDM4EATML3MBTL1HDAC4CYP1A2
SCHEMBL22454294 0.79 KDM4E (0.39) KDM4EATML3MBTL1HDAC4CYP1A2
SCHEMBL29362582 0.73 KDM4E (0.71) KDM4EATML3MBTL1CYP1A2CYP2C19
SCHEMBL23534547 0.73 KDM4E (0.71) KDM4EATML3MBTL1CYP1A2CYP2C19
SCHEMBL64816 0.73 KDM4E (0.71) KDM4EATML3MBTL1CYP1A2CYP2C19
SCHEMBL18214486 0.73 KDM4E (0.54) KDM4EATML3MBTL1HDAC4CYP1A2
SCHEMBL12937930 0.72 KDM4E (0.48) KDM4EATML3MBTL1CYP1A2CYP2C19
SCHEMBL6088665 0.72 KDM4E (0.48) KDM4EATML3MBTL1CYP1A2CYP2C19
SCHEMBL16521581 0.72 KDM4E (0.48) KDM4EATML3MBTL1HDAC4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11774653-B2 Wavelength conversion film, light-emitting member, authentication device, wristband type electronic apparatus and biometric device Konica Minolta, Inc. (JP) 2023-10-03 — — US disclosed
US-20200303660-A1 ORGANIC PHOTOSENSITIVE DEVICES COMPRISING ARYL SQUARAINES AND METHODS OF MAKING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-09-24 — — US disclosed
US-10333079-B2 Organic photosensitive devices comprising aryl squaraines and methods of making the same UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2019-06-25 — — US disclosed
US-20160005983-A1 ORGANIC PHOTOSENSITIVE DEVICES COMPRISING ARYL SQUARAINES AND METHODS OF MAKING THE SAME UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2016-01-07 — — US disclosed
US-20120248419-A1 ORGANIC PHOTOSENSITIVE DEVICES COMPRISING ARYL SQUARAINES AND METHODS OF MAKING THE SAME ENERGY, UNITED STATES DEPARTMENT OF 2012-10-04 — — 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 (4 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-20160005983-A1 ORGANIC PHOTOSENSITIVE DEVICES COMPRISING ARYL SQUARAINES AND METHODS OF MAKING THE SAME TYR, SQLE, SPIN3 KDM4E 3338/4885ATM 1723/4885L3MBTL1 1337/4885
US-20120248419-A1 ORGANIC PHOTOSENSITIVE DEVICES COMPRISING ARYL SQUARAINES AND METHODS OF MAKING THE SAME TYR, SQLE, SPIN3 KDM4E 3338/4885ATM 1723/4885L3MBTL1 1337/4885
US-10333079-B2 Organic photosensitive devices comprising aryl squaraines and methods of making the same TYR, SQLE, SPIN3 KDM4E 3338/4885ATM 1723/4885L3MBTL1 1337/4885
US-20200303660-A1 ORGANIC PHOTOSENSITIVE DEVICES COMPRISING ARYL SQUARAINES AND METHODS OF MAKING THE SAME TYR, SQLE, SPIN3 KDM4E 3338/4885ATM 1723/4885L3MBTL1 1337/4885

“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.

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