SCHEMBL8638840

SCHEMBL8638840

CCOC(=O)C(CCCCCC(=O)O)(CCCCCC(=O)O)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
GPR84 Q9NQS5 7/20 0.47
PPARG P37231 7/20 0.47
PPARD Q03181 7/20 0.47
PPARA Q07869 7/20 0.47
HDAC11 Q96DB2 5/20 0.47
TSHR P16473 5/20 0.47
PTPN1 P18031 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TLR2 O60603 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
FABP4 P15090 2/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
SLC22A8 Q8TCC7 1/20 0.47
ESR1 P03372 1/20 0.47
ALOX15 P16050 1/20 0.47
PDE4A P27815 1/20 0.47

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
SCHEMBL6762091 0.84 MEN1 (0.55) MEN1KMT2ACYP4F2CYP4A11TSHR
SCHEMBL11783157 0.84 CYP4F2 (0.46) MEN1KMT2ACYP4F2CYP4A11GPR84
SCHEMBL22190459 0.84 CYP4F2 (0.69) MEN1KMT2ACYP4F2CYP4A11GPR84
SCHEMBL11063113 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT
SCHEMBL183166 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT
SCHEMBL7516322 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT
SCHEMBL7516454 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT
SCHEMBL8216269 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT
SCHEMBL21046041 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT
SCHEMBL11001712 0.82 MEN1 (0.59) MEN1KMT2ACYP4F2CYP4A11HTT

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
EP-0594577-B1 NOVEL POTENT INDUCERS OF TERMINAL DIFFERENTIATION AND METHOD OF USE THEREOF SLOAN KETTERING INST CANCER (US) 1998-12-30 EP disclosed
US-5840960-A ANTITUMOR SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1998-11-24 US disclosed
US-5608108-A ANTITUMOR AGENTS; LUNG, BLADDER, KIDNEY, BREAST, COLORECTAL SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1997-03-04 US disclosed
US-5175191-A Antitumor agents or anticancer agents SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-12-29 US disclosed
WO-1991000257-A1 NOVEL POTENT INDUCERS OF TERMINAL DIFFERENTIATION AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1991-01-10 WO disclosed