SCHEMBL17084352

SCHEMBL17084352

CCCC1(CCC)c2cc(C(C)=O)ccc2-c2ccc(C(=O)c3ccccc3C)cc21

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 4/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ HTT P42858 2/20 0.41
▸ MAPK13 O15264 2/20 0.39
▸ MAPK12 P53778 2/20 0.39
▸ MAPK11 Q15759 2/20 0.39
▸ MAPK14 Q16539 2/20 0.39
▸ NPC1 O15118 2/20 0.37
▸ S100A4 P26447 1/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ F2R P25116 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PKM P14618 1/20 0.34

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
SCHEMBL30266914 1.00 PDK2 (0.42) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL17084351 0.91 ALDH1A1 (0.42) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL17084310 0.89 ALDH1A1 (0.39) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL17084349 0.89 ALDH1A1 (0.39) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL19186319 0.89 ALDH1A1 (0.39) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL17084350 0.85 ALDH1A1 (0.36) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL17877627 0.85 ALDH1A1 (0.36) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL29789550 0.85 ALDH1A1 (0.36) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL17056227 0.85 ALDH1A1 (0.36) PDK2ALDH1A1HTTMAPK13MAPK12
SCHEMBL21025031 0.84 ALDH1A1 (0.47) PDK2ALDH1A1HTTMAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113383021-B Colored curable resin composition 住友化学株式会社 2023-08-15 — — CN disclosed
CN-113383020-B Colored curable resin composition 住友化学株式会社 2023-03-28 — — CN disclosed
CN-106537254-B Photosensitive composition and compound 东京应化工业株式会社 2021-01-08 — — CN disclosed
WO-2020162009-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 2020-08-13 — — WO disclosed
WO-2020162008-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 2020-08-13 — — WO disclosed
WO-2020162010-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 2020-08-13 — — WO disclosed
WO-2020162007-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 2020-08-13 — — WO disclosed
EP-3165965-B1 PHOTOSENSITIVE COMPOSITION AND COMPOUND TOKYO OHKA KOGYO CO LTD (JP) 2018-10-10 — — EP disclosed
US-9684238-B2 Fluorene-type compound, photopolymerization initiator comprising said fluorene-type compound, and photosensitive composition containing said photopolymerization initiator TOKYO OHKA KOGYO CO., LTD. (JP) 2017-06-20 — — US disclosed
US-20170160636-A1 PHOTOSENSITIVE COMPOSITION AND COMPOUND TOKYO OHKA KOGYO CO., LTD. (JP) 2017-06-08 — — US disclosed
EP-3165965-A1 PHOTOSENSITIVE COMPOSITION AND COMPOUND Tokyo Ohka Kogyo Co., Ltd. (JP) 2017-05-10 — — EP disclosed
US-20150259321-A1 FLUORENE-TYPE COMPOUND, PHOTOPOLYMERIZATION INITIATOR COMPRISING SAID FLUORENE-TYPE COMPOUND, AND PHOTOSENSITIVE COMPOSITION CONTAINING SAID PHOTOPOLYMERIZATION INITIATOR DAITO CHEMIX CORPORATION (JP) 2015-09-17 — — 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-20150259321-A1 FLUORENE-TYPE COMPOUND, PHOTOPOLYMERIZATION INITIATOR COMPRISING SAID FLUORENE-TYPE COMPOUND, AND PHOTOSENSITIVE COMPOSITION CONTAINING SAID PHOTOPOLYMERIZATION INITIATOR AFF1, AFF2, FTO PDK2 1484/4885ALDH1A1 290/4885HTT 1962/4885
US-20170160636-A1 PHOTOSENSITIVE COMPOSITION AND COMPOUND C1R, CRY1, C1S PDK2 2998/4885ALDH1A1 1305/4885HTT 3433/4885

“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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