SCHEMBL24252008

SCHEMBL24252008

CC1(C)CCC(=O)OCC(C)(N)C1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
GABRP O00591 1/20 0.30
GABRD O14764 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30
GABRA4 P48169 1/20 0.30
GABRE P78334 1/20 0.30
GABRA6 Q16445 1/20 0.30
GABRG1 Q8N1C3 1/20 0.30
GABRG3 Q99928 1/20 0.30
GABRQ Q9UN88 1/20 0.30

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
SCHEMBL758910 0.79
SCHEMBL7113337 0.69 LMNA (0.45) ALDH1A1LMNATP53TSHRGABRP
SCHEMBL4134507 0.69 LMNA (0.48) ALDH1A1LMNATP53TSHR
SCHEMBL12689738 0.67
SCHEMBL18268917 0.67 CA1 (0.41) ALDH1A1LMNATP53TSHRGABRP
SCHEMBL19445439 0.67
SCHEMBL360166 0.66 CA1 (0.50) ALDH1A1LMNATP53TSHRGABRP
SCHEMBL18268906 0.65 CA1 (0.50) ALDH1A1LMNATP53TSHR
SCHEMBL18268916 0.65 CA1 (0.44) ALDH1A1LMNATP53TSHRGABRP
SCHEMBL9265626 0.64 CA1 (0.48) ALDH1A1LMNATP53TSHRGABRP

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
US-20220049041-A1 CROSS-LINKED POLYMERIC MATERIALS AND ARTICLES SAUDI ARABIAN OIL COMPANY (SA) 2022-02-17 US disclosed