SCHEMBL7046277

SCHEMBL7046277

Cc1ccc(C2CCC(C=O)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.44
MAP1LC3B Q9GZQ8 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
ESR2 Q92731 2/20 0.38
HDAC2 Q92769 1/20 0.38
CYP2A6 P11509 1/20 0.37
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
SLC2A1 P11166 1/20 0.34
NPC1 O15118 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL7046275 1.00 SLC18A3 (0.44) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL2270993 0.94 SLC18A3 (0.41) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL2270988 0.94 SLC18A3 (0.41) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL2270991 0.94 SLC18A3 (0.41) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL7882916 0.90 FFAR1 (0.44) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL6853901 0.89 HDAC2 (0.43) ESR2HDAC2NPC1RAB9APOLB
SCHEMBL14140574 0.89 LMNA (0.40) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL1405569 0.82 ESR2 (0.50) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL19294269 0.82 MAP1LC3B (0.42) SLC18A3MAP1LC3BSMN1; SMN2LMNATP53
SCHEMBL9252538 0.80 MAP1LC3B (0.40) MAP1LC3BSMN1; SMN2ALDH1A1ATMESR2

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
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-8512598-B2 Liquid crystal compounds and method for preparing the same DONGJIN SEMICHEM CO., LTD. (KR) 2013-08-20 US disclosed
EP-0759058-B1 SUPERTWIST LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2003-04-02 EP disclosed
US-6017469-A HAVING OUTSTANDING PROPERTIES WHEN THE NEMATIC LIQUID CRYSTAL MIXTURE CONTAINS AT LEAST ONE COMPOUND CONTAINING A 1,4-CYCLOHEXYLENE-CH=CH-GROUP; VERY SHORT RESPONSE TIMES; GOOD STEEPNESS AND ANGLE DEPENDENCIES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-01-25 US disclosed
EP-0759058-A1 SUPERTWIST LIQUID CRYSTAL DISPLAY MERCK PATENT GmbH (DE) 1997-02-26 EP disclosed
WO-1995030723-A1 SUPERTWIST LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 1995-11-16 WO disclosed