SCHEMBL7231237

SCHEMBL7231237

Fc1ccc(OCCCCl)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
FAAH O00519 1/20 0.39
HSPB1 P04792 1/20 0.39
GRM2 Q14416 1/20 0.38
DHFR P00374 1/20 0.38
DCPS Q96C86 1/20 0.38
TRPA1 O75762 1/20 0.37
IDO1 P14902 1/20 0.37
AGXT P21549 1/20 0.37
KDM1A O60341 2/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
MAP4K4 O95819 1/20 0.37

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
SCHEMBL31702467 1.00 L3MBTL1 (0.42) L3MBTL1TDP1ALDH1A1MEN1POLB
SCHEMBL21388207 0.88 L3MBTL1 (0.48) L3MBTL1TDP1ALDH1A1MEN1POLB
SCHEMBL7528742 0.84 HTR1B (0.46) L3MBTL1TDP1ALDH1A1MEN1POLB
SCHEMBL10523172 0.83 ALDH1A1 (0.43) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL11669016 0.82 S1PR4 (0.49) L3MBTL1ALDH1A1MEN1POLBHPGD
SCHEMBL878692 0.82 FAAH (0.53) L3MBTL1TDP1ALDH1A1MEN1POLB
SCHEMBL3064992 0.82 L3MBTL1 (0.41) L3MBTL1TDP1ALDH1A1MEN1POLB
SCHEMBL21601494 0.82 KDM4E (0.54) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL29546953 0.82 KDM4E (0.54) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL10458633 0.82 HTR2A (0.50) L3MBTL1TDP1ALDH1A1MEN1POLB

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
EP-4493559-A2 ORGANIC COMPOUNDS Intra-Cellular Therapies, Inc. (US) 2025-01-22 EP disclosed
WO-2023178113-A2 ORGANIC COMPOUNDS INTRA-CELLULAR THERAPIES, INC. (US) 2023-09-21 WO disclosed
US-6649623-B1 Administering tetrahydropiperidine derivative; antidiabetic agents; hyperlipemia treatment; hypotensive agents SHIONOGI & CO., LTD. (JP) 2003-11-18 US disclosed
EP-1151993-A1 CYCLIC AMINE DERIVATIVES AND USES THEREOF SHIONOGI & CO., LTD. (JP) 2001-11-07 EP disclosed