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SCHEMBL21944399

SCHEMBL21944399

Cc1ccc(-c2ccc(-c3cc(-c4cccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)c4)c(-c4ccc(-c5ccc(C)cc5C)cc4)cc3-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)cc2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ OPRD1 P41143 7/20 0.33
▸ OPRM1 P35372 2/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ SERPINE1 P05121 2/20 0.33
▸ NOTUM Q6P988 1/20 0.32
▸ HTR1A P08908 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ PTAFR P25105 1/20 0.31
▸ OPRK1 P41145 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30

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
SCHEMBL21944405 0.88 ALDH1A1 (0.38) ALDH1A1MAPTOPRD1OPRM1SERPINE1
SCHEMBL21943772 0.88 OPRD1 (0.38) ALDH1A1MAPTOPRD1OPRM1SERPINE1
SCHEMBL25693139 0.84 ALDH1A1 (0.41) ALDH1A1MAPTOPRD1OPRM1SERPINE1
SCHEMBL21943771 0.81 OPRD1 (0.37) ALDH1A1MAPTOPRD1OPRM1CNR1
SCHEMBL8739889 0.79 KIF11 (0.42) ALDH1A1MAPTOPRD1OPRM1SERPINE1
SCHEMBL21944403 0.78 PTGES (0.36) ALDH1A1MAPTSERPINE1
SCHEMBL2607410 0.78 TDP1 (0.43) ALDH1A1OPRD1OPRM1NOTUM
SCHEMBL21943770 0.78 PGR (0.34) ALDH1A1MAPTOPRD1NOTUM
SCHEMBL21944073 0.77 DNMT1 (0.40) ALDH1A1MAPTSERPINE1
SCHEMBL21943981 0.77 TSHR (0.41) ALDH1A1MAPTSERPINE1PTAFR

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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