SCHEMBL23089913

SCHEMBL23089913

COc1c2ccccc2cc2ccc(C)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP2A6 P11509 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
CYP1A2 P05177 5/20 0.46
POLB P06746 1/20 0.46
ERN1 O75460 1/20 0.45
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43

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
SCHEMBL16920395 0.89 CYP1A2 (0.50) ALDH1A1KDM4EMAPK1SMN1; SMN2CYP2A6
SCHEMBL599396 0.86 ALDH1A1 (0.67) ALDH1A1KDM4EMAPK1SMN1; SMN2CYP2A6
SCHEMBL30949367 0.86 ALDH1A1 (0.67) ALDH1A1KDM4EMAPK1SMN1; SMN2CYP2A6
SCHEMBL29118946 0.82 ALDH1A1 (0.56) ALDH1A1KDM4EMAPK1SMN1; SMN2CYP2A6
SCHEMBL27861347 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EMAPK1SMN1; SMN2CYP2A6
SCHEMBL28702859 0.81 CYP1A2 (0.59) ALDH1A1KDM4EMAPK1SMN1; SMN2CYP2A6
SCHEMBL23271811 0.81 CYP2A6 (0.42) ALDH1A1CYP2A6TDP1CYP1A2TUBB4A
SCHEMBL23089898 0.81 CYP2A6 (0.42) ALDH1A1KDM4ECYP2A6TDP1CYP1A2
SCHEMBL23271740 0.80 CYP2A6 (0.39) ALDH1A1KDM4ESMN1; SMN2CYP2A6TDP1
SCHEMBL30003120 0.80 CYP2A6 (0.39) ALDH1A1KDM4ESMN1; SMN2CYP2A6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11613509-B2 Radical polymerization control agent and radical polymerization control method KAWASAKI KASEI CHEMICALS LTD. (JP) 2023-03-28 US disclosed
CN-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed
US-11352450-B2 Photopolymerization sensitizer composition KAWASAKI KASEI CHEMICALS LTD. (JP) 2022-06-07 US disclosed
CN-111868105-B Photopolymerizable sensitizer composition 川崎化成工业株式会社 2022-05-13 CN disclosed
CN-106970503-B Photosensitive composition 东京应化工业株式会社 2022-02-01 CN disclosed
US-20210122692-A1 RADICAL POLYMERIZATION CONTROL AGENT AND RADICAL POLYMERIZATION CONTROL METHOD KAWASAKI KASEI CHEMICALS LTD. (JP) 2021-04-29 US disclosed
US-20210079127-A1 PHOTOPOLYMERIZATION SENSITIZER COMPOSITION KAWASAKI KASEI CHEMICALS LTD. (JP) 2021-03-18 US disclosed
CN-112394617-A Photosensitive resin composition, method for producing patterned cured film, and patterned cured film 东京应化工业株式会社 2021-02-23 CN disclosed
CN-111868105-A Photopolymerizable sensitizer composition 川崎化成工业株式会社 2020-10-30 CN disclosed
CN-111796482-A Photosensitive resin composition, method for producing patterned cured film, and patterned cured film 东京应化工业株式会社 2020-10-20 CN disclosed
CN-111240156-A Photosensitive resin composition, method for producing patterned cured film, and patterned cured film 东京应化工业株式会社 2020-06-05 CN disclosed
CN-110955114-A Photosensitive resin composition, method for producing patterned cured film, and cured film 东京应化工业株式会社 2020-04-03 CN disclosed
CN-110891980-A Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2020-03-17 CN disclosed
CN-102232065-B Photobase generator WAKO PURE CHEM IND LTD 2014-11-05 CN disclosed
CN-102232065-A Photobase generator WAKO PURE CHEM IND LTD 2011-11-02 CN 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-11613509-B2 Radical polymerization control agent and radical polymerization control method PPOX, NOX4, CROCC ALDH1A1 1023/4885KDM4E 1028/4885MAPK1 3189/4885
US-20210122692-A1 RADICAL POLYMERIZATION CONTROL AGENT AND RADICAL POLYMERIZATION CONTROL METHOD PPOX, NOX4, CROCC ALDH1A1 1023/4885KDM4E 1028/4885MAPK1 3189/4885

“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.