SCHEMBL6689439

SCHEMBL6689439

CC(N[C@H]1CCC[C@@H]1O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
RECQL P46063 1/20 0.50
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.44
ATM Q13315 1/20 0.44
EPHX1 P07099 2/20 0.43
LMNA P02545 2/20 0.43
USP2 O75604 1/20 0.43
ALOX15 P16050 1/20 0.43
HPGD P15428 2/20 0.41
MAN2A1 Q16706 1/20 0.41
MAN1B1 Q9UKM7 1/20 0.41
KDM1A O60341 1/20 0.41
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
MMP2 P08253 1/20 0.40
MMP13 P45452 1/20 0.40
PTGS1 P23219 1/20 0.39

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
SCHEMBL7176509 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL27354336 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL7176506 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL9739600 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL6688840 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL7176504 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL6688839 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL9739593 1.00 GAA (0.57) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL9017288 0.97 GAA (0.62) GAAL3MBTL1RECQLMEN1KMT2A
SCHEMBL697464 0.97 GAA (0.62) GAAL3MBTL1RECQLMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004089871-A1 TRANS-2-[(α-METHYLBENZYL)AMINO]CYCLOPENTANOL BEING PURE AS DIASTEREOISOMER TAMA KAGAKU KOGYO CO., LTD. (JP) 2004-10-21 WO disclosed
US-5141944-A Sexual dysfunction, hypotensive, antiischemic agents, headache, psychological disorders ELI LILLY AND COMPANY (US) 1992-08-25 US disclosed
US-5043341-A N-(2-hydroxycyclopentyl)-1-isopropyl-6-methylergoline-8-carboxamides ELI LILLY AND COMPANY (US) 1991-08-27 US disclosed