SCHEMBL30452697

SCHEMBL30452697

COc1ccc(Cl)cc1C1COCN1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.41
▸ HTR3A P46098 3/20 0.38
▸ HTR3E A5X5Y0 2/20 0.38
▸ HTR3B O95264 2/20 0.38
▸ HTR3D Q70Z44 2/20 0.38
▸ HTR3C Q8WXA8 2/20 0.38
▸ HTR2C P28335 9/20 0.37
▸ HTR2B P41595 7/20 0.37
▸ HTR2A P28223 6/20 0.37
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ PDE1B Q01064 2/20 0.36
▸ PDE2A O00408 1/20 0.36
▸ PDE8B O95263 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PDE1A P54750 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ PDE1C Q14123 1/20 0.36
▸ PDE11A Q9HCR9 1/20 0.36

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
SCHEMBL29015610 1.00 TP53 (0.41) TP53HTR3AHTR3EHTR3BHTR3D
SCHEMBL20855753 0.74 TP53 (0.43) TP53HTR3AHTR3EHTR3BHTR3D
SCHEMBL20855751 0.74 TP53 (0.43) TP53HTR3AHTR3EHTR3BHTR3D
SCHEMBL30452007 0.74 TTR (0.32) TTR
SCHEMBL29015546 0.74 TTR (0.32) TTR
SCHEMBL14833093 0.71 HTR2C (0.50) HTR2CHTR2BHTR2ATSHRHPGD
SCHEMBL24252872 0.71 PTGDR2 (0.46) TP53ALDH1A1
SCHEMBL13651802 0.69 TP53 (0.39) TP53HTR3AHTR3EHTR3BHTR3D
SCHEMBL12309442 0.68 KDM1A (0.47) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL1093945 0.68 HTR2C (0.61) HTR3AHTR3EHTR3BHTR3DHTR3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 — — CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 — — CN disclosed
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