SCHEMBL20826221

SCHEMBL20826221

CC(C)(C)c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C(C)(C)C)cc4)ccc2n3-c2ccc3ccc(-n4c5ccc(-c6ccc(C(C)(C)C)cc6)cc5c5cc(-c6ccc(C(C)(C)C)cc6)ccc54)cc3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.41
▸ KIF11 P52732 3/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ PDPK1 O15530 2/20 0.34
▸ SERPINE1 P05121 3/20 0.33
▸ CASR P41180 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRD1 P41143 1/20 0.33
▸ PIK3CA P42336 1/20 0.32
▸ TDO2 P48775 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ ICMT O60725 1/20 0.32

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
SCHEMBL20825698 0.95 PTGES (0.44) PTGESKIF11KCNH2PDPK1SERPINE1
SCHEMBL20826117 0.91 KCNH2 (0.39) PTGESKIF11KCNH2SERPINE1CASR
SCHEMBL20826223 0.91 KCNH2 (0.39) PTGESKIF11KCNH2SERPINE1CASR
SCHEMBL20850481 0.89 PTGES (0.45) PTGESKIF11KCNH2SERPINE1NR1H4
SCHEMBL20826233 0.86 PTGES (0.42) PTGESKIF11KCNH2SERPINE1CASR
SCHEMBL20825696 0.86 PTGES (0.42) PTGESKIF11KCNH2SERPINE1CASR
SCHEMBL21944398 0.84 PTGES (0.35) PTGESKCNH2CASRNPC1RAB9A
SCHEMBL28805106 0.83 PTGES (0.35) PTGESKIF11KCNH2PIK3CACA12
SCHEMBL19735301 0.83 PTGES (0.44) PTGESKIF11SERPINE1NR1H4PPARG
SCHEMBL16520483 0.82 PTGES (0.39) PTGESSERPINE1NR1H4OPRM1OPRD1

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-11793074-B2 Organic compound and photoelectric conversion element CANON KABUSHIKI KAISHA (JP) 2023-10-17 — — US disclosed
US-11793074-B2 Organic compound and photoelectric conversion element CANON KABUSHIKI KAISHA (JP) 2023-10-17 — — US disclosed
US-20210057653-A1 ORGANIC COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT CANON KK (JP) 2021-02-25 — — US disclosed
US-10868260-B2 Organic compound and photoelectric conversion element CANON KABUSHIKI KAISHA (JP) 2020-12-15 — — US disclosed
US-20190088885-A1 ORGANIC COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT CANON KABUSHIKI KAISHA (JP) 2019-03-21 — — 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 (3 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-11793074-B2 Organic compound and photoelectric conversion element CRY1, CYP1A1, CCNE2 PTGES 3027/4885KIF11 3445/4885KCNH2 83/4885
US-20210057653-A1 ORGANIC COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT CRY1, CYP1A1, CCNE2 PTGES 3027/4885KIF11 3445/4885KCNH2 83/4885
US-10868260-B2 Organic compound and photoelectric conversion element CRY1, CYP1A1, CCNE2 PTGES 3027/4885KIF11 3445/4885KCNH2 83/4885

“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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