SCHEMBL24770775

SCHEMBL24770775

Cc1cc2c(cc1N)CC1CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CHRNB2 P17787 2/20 0.31
CHRNA4 P43681 2/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 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
SCHEMBL20647971 0.73 CYP3A4 (0.39) CYP3A4TSHRMAPK1
SCHEMBL2914386 0.72 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL22035738 0.69 CYP3A4 (0.32) CYP3A4TSHRMAPK1
SCHEMBL9819248 0.63 CYP3A4 (0.41) CYP3A4TSHRMAPK1
SCHEMBL11705873 0.63 CHRNB2 (0.59) CHRNB2CHRNA4
SCHEMBL917520 0.63 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL22235355 0.63 POLB (0.47) CYP3A4TSHRMAPK1
SCHEMBL13569777 0.63 CYP3A4 (0.41) CYP3A4TSHRMAPK1
SCHEMBL13569861 0.63 CYP3A4 (0.41) CYP3A4TSHRMAPK1
SCHEMBL26552882 0.63 CYP3A4 (0.37) CYP3A4TSHRMAPK1

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
EP-4106032-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2022-12-21 EP disclosed