SCHEMBL9252545

SCHEMBL9252545

O=CC1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP1LC3B Q9GZQ8 1/20 0.40
HDAC2 Q92769 1/20 0.38
KDM1A O60341 2/20 0.36
PTGS1 P23219 2/20 0.36
PTGS2 P35354 2/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ESR2 Q92731 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PARP10 Q53GL7 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.34

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
SCHEMBL9252538 1.00 MAP1LC3B (0.40) MAP1LC3BHDAC2KDM1APTGS1PTGS2
SCHEMBL6853901 0.89 HDAC2 (0.43) HDAC2ESR2
SCHEMBL9517895 0.89 KDM1A (0.38) MAP1LC3BHDAC2KDM1APTGS1PTGS2
SCHEMBL6455518 0.83 MAP1LC3B (0.35) MAP1LC3BHDAC2KDM1APTGS1PTGS2
SCHEMBL6455522 0.83 MAP1LC3B (0.35) MAP1LC3BHDAC2KDM1APTGS1PTGS2
SCHEMBL1066184 0.82 KDM1A (0.48) MAP1LC3BKDM1APTGS1PTGS2ESR2
SCHEMBL18161913 0.82 KDM1A (0.48) MAP1LC3BKDM1APTGS1PTGS2ESR2
SCHEMBL16761996 0.82 KDM1A (0.42) MAP1LC3BKDM1ATDP1ATM
SCHEMBL16761993 0.82 KDM1A (0.42) MAP1LC3BKDM1ATDP1ATM
Ammonia Solution, Strong SCHEMBL22408764 0.80 KDM1A (0.46) MAP1LC3BKDM1APTGS1PTGS2ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727940-A1 DIHYDROPYRIMIDINE-2, 4 (1H, 3H) -DIONE-CONTAINING POLYCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF, PREPARATION METHOD THEREOF AND USE THEREOF Linkcure Therapeutics (KY) 2026-04-22 EP disclosed
WO-2024255810-A1 DIHYDROPYRIMIDINE-2, 4 (1H, 3H) -DIONE-CONTAINING POLYCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF, PREPARATION METHOD THEREOF AND USE THEREOF HANGZHOU GLUBIO PHARMACEUTICAL CO., LTD (CN) 2024-12-19 WO disclosed
CN-109952300-B 5-or 8-substituted imidazo [1,5-a ] pyridines 百济神州有限公司 2022-01-18 CN disclosed
US-5454974-A Halobenzene liquid crystals HOFFMANN-LA ROCHE INC. (US) 1995-10-03 US disclosed
US-5302317-A Halobenzene liquid crystals HOFFMANN-LA ROCHE INC. (US) 1994-04-12 US disclosed
US-5230826-A HALOBENZENE LIQUID CRYSTALS HOFFMANN-LA ROCHE INC. (US) 1993-07-27 US disclosed