SCHEMBL11089084

SCHEMBL11089084

CC(C)NCCCC1(O)c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HTR1B P28222 2/20 0.40
NR2E1 Q9Y466 1/20 0.40
RAB9A P51151 1/20 0.40
PKM P14618 1/20 0.39
LMNA P02545 1/20 0.38
CACNA2D1 P54289 1/20 0.38
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2D6 P10635 1/20 0.35
HIF1A Q16665 1/20 0.35
ADRB2 P07550 1/20 0.35

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
SCHEMBL11092069 0.95 KDM4E (0.43) KDM4EALDH1A1HTR1BNR2E1RAB9A
SCHEMBL11204381 0.80 PDK2 (0.37) KDM4EALDH1A1LMNAHSP90AA1HSP90AB1
SCHEMBL17445904 0.78 PDK2 (0.46) KDM4EALDH1A1RAB9APKMLMNA
Indecainide SCHEMBL121202 0.78 KDM4E (0.42) KDM4EALDH1A1KMT2A
SCHEMBL11079235 0.77 KDM4E (0.36) KDM4EALDH1A1HTR1BNR2E1LMNA
Indecainide SCHEMBL121201 0.77 KDM4E (0.41) KDM4EALDH1A1
Indecainide SCHEMBL11086669 0.77 KDM4E (0.41) KDM4EALDH1A1
SCHEMBL11090876 0.77 KDM4E (0.41) KDM4EALDH1A1
Indecainide SCHEMBL29397898 0.77 KDM4E (0.41) KDM4EALDH1A1
Bromide SCHEMBL11494297 0.76 L3MBTL1 (0.38) KDM4EALDH1A1RAB9APKMLMNA

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
US-4452745-A ANTIARRHYTHMIA AGENTS ELI LILLY AND COMPANY (US) 1984-06-05 US disclosed
EP-0018076-B1 9-AMINOALKYLFLUORENES, PROCESS THEREFOR AND ANTIARRHYTHMIC FORMULATIONS THEREOF ELI LILLY AND COMPANY (US) 1983-09-21 EP disclosed
US-4382093-A 9-Aminoalkylfluorenes ELI LILLY AND COMPANY (US) 1983-05-03 US disclosed
US-4277495-A FLUORENE 9-AMINOALKYL-9-CARBOXYLIC ACIDS OR ESTERS ELI LILLY AND COMPANY (US) 1981-07-07 US disclosed
EP-0018076-A1 9-Aminoalkylfluorenes, process therefor and antiarrhythmic formulations thereof ELI LILLY AND COMPANY (US) 1980-10-29 EP disclosed
US-4197313-A USE OF 9-AMINOALKYL-9-(HYDROXY, CYANO OR CARBAMOYL)-FLUORENES ELI LILLY AND COMPANY (US) 1980-04-08 US disclosed