SCHEMBL6055419

SCHEMBL6055419

CCCCC(O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
KCNH2 Q12809 2/20 0.46
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
CACNA1F O60840 1/20 0.46
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
EGFR P00533 1/20 0.46
CYP1A2 P05177 1/20 0.46
FYN P06241 1/20 0.46
CHRM2 P08172 1/20 0.46
ABCB1 P08183 1/20 0.46
CYP3A4 P08684 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL6055147 0.90 GRIA4 (0.45) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL6827541 0.85 LMNA (0.46) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL28691397 0.83 HSD11B1 (0.46) LMNAKCNH2MEN1KMT2ACACNA1F
SCHEMBL8418135 0.83 LMNA (0.45) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL17023787 0.83 LMNA (0.45) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL24298369 0.83 LMNA (0.45) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL8418142 0.83 LMNA (0.45) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL3187891 0.82 LMNA (0.45) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL6055239 0.82 LMNA (0.56) LMNAKCNH2MEN1MAPTKMT2A
SCHEMBL20748168 0.81 GRIA4 (0.47) LMNARIPK1HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7858798-B2 metabolite of ebastine ALBANY MOLECULAR RESEARCH, INC. (US) 2010-12-28 US disclosed
US-20090137813-A1 PROCESS FOR PRODUCTION OF CAREBASTINE ALBANY MOLECULAR RESEARCH, INC. (US) 2009-05-28 US disclosed
EP-1300381-B1 Process for preparing optically active alcohols JAPAN SCIENCE & TECH AGENCY (JP) 2006-03-08 EP disclosed
US-6887820-B1 For producing optically active secondary alcohols, producing optically active compounds useful for various utilities such as intermediates for synthesizing pharmaceutical agents, liquid crystal materials and agents for optical resolution JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2005-05-03 US disclosed
EP-1300381-A1 Process for preparing optically active alcohols Japan Science and Technology Corporation (JP) 2003-04-09 EP disclosed
US-6184381-B1 USEFUL AS INTERMEDIATES FOR SYNTHESIZING PHARMACEUTICAL CHEMICALS, LIQUID CRYSTAL MATERIALS AND AGENTS FOR OPTICAL RESOLUTION, REDUCTION, KETONES TO ALCOHOL, IMINES TO AMINES JAPAN SCIENCE & TECHNOLOGY CORP. (JP) 2001-02-06 US disclosed
EP-0916637-A1 PROCESS FOR PREPARATING OPTICALLY ACTIVE COMPOUNDS Japan Science and Technology Corporation (JP) 1999-05-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090137813-A1 PROCESS FOR PRODUCTION OF CAREBASTINE GABRE, GABRB3, GABRB2 LMNA 3783/4885KCNH2 1006/4885MEN1 4057/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.