SCHEMBL28289591

SCHEMBL28289591

O=CCCn1c2ccc(F)cc2c2cc(F)ccc21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
PER2 O15055 15/20 0.45
CRY2 Q49AN0 13/20 0.41
CRY1 Q16526 8/20 0.40

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
SCHEMBL28228399 0.79 MAPT (0.47)
SCHEMBL28229124 0.79 RORA (0.47) KDM4EALDH1A1
SCHEMBL8143242 0.76 MAPT (0.52) KDM4EALDH1A1PER2CRY2CRY1
SCHEMBL17955862 0.74 PTGER4 (0.49) KDM4EALDH1A1PER2CRY2CRY1
SCHEMBL16156855 0.74 FABP4 (0.59) KDM4EALDH1A1PER2CRY2
SCHEMBL16098656 0.73 FABP4 (0.53) KDM4E
SCHEMBL8148630 0.73 MAPT (0.54) KDM4EALDH1A1PER2CRY2CRY1
SCHEMBL31609292 0.71 PER2 (0.48) ALDH1A1PER2CRY2CRY1
SCHEMBL29623057 0.71 PER2 (0.51) ALDH1A1PER2
SCHEMBL29165319 0.71 PER2 (0.42) KDM4EALDH1A1PER2CRY2CRY1

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-111285793-B Fluorine-substituted bimolecular carbazole derivative, and preparation method and application thereof 广州中医药大学(广州中医药研究院) 2022-04-22 CN disclosed
CN-111285793-A Fluorine-substituted bimolecular carbazole derivative, and preparation method and application thereof 广州中医药大学(广州中医药研究院) 2020-06-16 CN disclosed
CN-110003172-A The amides containing carbazole, carbamates and ureas as cryptochrome regulator 同步制药公司 2019-07-12 CN disclosed
CN-106458891-B Carbazole-containing amides, carbamates, and ureas as cryptochrome modulators 同步制药公司 2019-04-09 CN disclosed