SCHEMBL11089092

SCHEMBL11089092

C=CCNCCCC1(C(=O)NCCCCCC)c2ccccc2-c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTTP P55157 1/20 0.43
ASAH1 Q13510 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX1 P07099 3/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
NAAA Q02083 1/20 0.40

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
SCHEMBL10780990 0.84 MTTP (0.39) MTTPASAH1EPHX1ALDH1A1HTT
SCHEMBL6648109 0.80 TSHR (0.44) MTTPASAH1KMT2AHTT
SCHEMBL6648420 0.77 PDK2 (0.45) MTTPASAH1NAAA
SCHEMBL11208949 0.75 SIGMAR1 (0.41) MTTPASAH1NAAA
SCHEMBL11091963 0.75 GAA (0.44) GAAKMT2AALDH1A1HTT
SCHEMBL5863509 0.73 MTTP (0.41) MTTPALDH1A1
SCHEMBL6649444 0.73 MTTP (0.49) MTTP
Isopropylamine SCHEMBL11190763 0.72 MTTP (0.49) MTTP
SCHEMBL11205330 0.72 SIGMAR1 (0.45) ASAH1KMT2AEPHX1ALDH1A1HTT
SCHEMBL6766343 0.72 MTTP (0.48) MTTP

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 5 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