SCHEMBL29448065

SCHEMBL29448065

CC(O)CNCC(O)Cn1c2ccc(F)cc2c2cc(F)ccc21

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CRY2 Q49AN0 17/20 0.64
▸ PER2 O15055 15/20 0.64
▸ CRY1 Q16526 11/20 0.64
▸ DNM1 Q05193 1/20 0.52

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
SCHEMBL28406050 1.00 CRY2 (0.64) CRY2PER2CRY1DNM1
SCHEMBL28410416 0.94 DNM1 (0.62) CRY2PER2CRY1DNM1
SCHEMBL15383975 0.87 PER2 (0.66) CRY2PER2CRY1DNM1
SCHEMBL17138607 0.84 CRY2 (0.59) CRY2PER2CRY1
SCHEMBL17138610 0.84 CRY2 (0.59) CRY2PER2CRY1
SCHEMBL17163870 0.84 CRY2 (0.59) CRY2PER2CRY1
SCHEMBL15383988 0.83 CRY2 (0.69) CRY2PER2CRY1DNM1
SCHEMBL17138574 0.82 CRY2 (0.57) CRY2PER2CRY1DNM1
SCHEMBL30145447 0.82 CRY2 (0.57) CRY2PER2CRY1DNM1
SCHEMBL17138635 0.82 PER2 (0.60) CRY2PER2CRY1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111217741-B Fluorine-substituted monocarbazole derivative, preparation method and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2022-03-15 — — CN disclosed
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