SCHEMBL28268018

SCHEMBL28268018

C1=CC2=NC1=CC1=NC(=CC3=NC(=CC4=NC(=C2)C=C4)C=C3c2ccccc2-c2ccncc2)C=C1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ IMPDH2 P12268 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ NOTUM Q6P988 1/20 0.31

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
SCHEMBL5470460 0.85 LMNA (0.32) MAPT
SCHEMBL28874540 0.85 ABL1 (0.38) MAPTSMN1; SMN2HSD17B10
Hydrochloric Acid SCHEMBL16188262 0.84 LMNA (0.31) MAPT
Hydrochloric Acid SCHEMBL16188244 0.84 LMNA (0.31) MAPT
SCHEMBL28351486 0.84 LMNA (0.31) MAPT
SCHEMBL473159 0.77 MAOA (0.32) —
SCHEMBL28218445 0.77 ALDH1A1 (0.34) ALDH1A1HSD17B10
SCHEMBL28267207 0.77 ALDH1A1 (0.34) ALDH1A1HSD17B10
SCHEMBL28088146 0.77 ALDH1A1 (0.34) ALDH1A1HSD17B10
SCHEMBL3076219 0.77 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114790336-A Preparation method and application of adjustable porphyrin MOFs film 闽江学院 2022-07-26 — — CN claimed
CN-114790336-B Preparation method and application of controllable porphyrin MOFs film 闽江学院 2023-06-16 — — CN disclosed
CN-114790336-A Preparation method and application of adjustable porphyrin MOFs film 闽江学院 2022-07-26 — — CN disclosed
CN-109143655-A A kind of intelligent dimming glass and its preparation method and application including metal organic frame film 中国科学院福建物质结构研究所 2019-01-04 — — CN disclosed
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