SCHEMBL21944403

SCHEMBL21944403

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2cc(-c3cc(-c4ccccc4)c(-c4ccc5cc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)ccc5c4)cc3-c3ccccc3)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.36
▸ DNMT1 P26358 3/20 0.36
▸ GPR84 Q9NQS5 1/20 0.34
▸ PPARG P37231 3/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ PGR P06401 1/20 0.33
▸ RORA P35398 1/20 0.33
▸ RORC P51449 1/20 0.33
▸ RORB Q92753 1/20 0.33
▸ MDM2 Q00987 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ KIF11 P52732 1/20 0.33
▸ SERPINE1 P05121 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ NR1H4 Q96RI1 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
SCHEMBL21944402 0.93 PTGES (0.38) PTGESDNMT1GPR84PPARGKCNH2
SCHEMBL21944398 0.90 PTGES (0.35) PTGESDNMT1GPR84KCNH2ALDH1A1
SCHEMBL21944027 0.89 KCNH2 (0.40) PTGESDNMT1PPARGKCNH2ALDH1A1
SCHEMBL21944073 0.89 DNMT1 (0.40) PTGESDNMT1GPR84PPARGKCNH2
SCHEMBL21944030 0.88 DNMT1 (0.39) PTGESDNMT1GPR84PPARGALDH1A1
SCHEMBL20825696 0.86 PTGES (0.42) PTGESDNMT1PPARGKCNH2ALDH1A1
SCHEMBL20826233 0.86 PTGES (0.42) PTGESDNMT1PPARGKCNH2ALDH1A1
SCHEMBL18267233 0.86 PTGES (0.40) PTGESDNMT1PPARGKCNH2ALDH1A1
SCHEMBL18267242 0.84 PTGES (0.39) PTGESDNMT1PPARGKCNH2ALDH1A1
SCHEMBL21943772 0.84 OPRD1 (0.38) DNMT1ALDH1A1MAPTPGRRORA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145492-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGE PICKUP ELEMENT, AND IMAGE PICKUP APPARATUS CANON KK (JP) 2023-05-11 — — US disclosed
US-20230145492-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGE PICKUP ELEMENT, AND IMAGE PICKUP APPARATUS CANON KK (JP) 2023-05-11 — — US disclosed
US-20200119281-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGE PICKUP ELEMENT, AND IMAGE PICKUP APPARATUS CANON KABUSHIKI KAISHA (JP) 2020-04-16 — — US disclosed
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