SCHEMBL4126330

SCHEMBL4126330

COc1cc(-c2cccc(CN(c3ccc(OC(F)(F)F)cc3)C3CCN(C(=O)OC(C)(C)C)CC3)c2)cc(OC)c1OC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.50
CCR5 P51681 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
SLC2A1 P11166 1/20 0.42
KDM1A O60341 1/20 0.41
EPHX2 P34913 1/20 0.41
KCNH2 Q12809 1/20 0.40
SCN5A Q14524 1/20 0.40
SCN9A Q15858 1/20 0.40
TGFBR1 P36897 2/20 0.40
LIPE Q05469 1/20 0.40
STS P08842 1/20 0.39
USP30 Q70CQ3 1/20 0.39
ABHD6 Q9BV23 1/20 0.39
DAGLA Q9Y4D2 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
SCHEMBL4116242 0.93 GPR119 (0.49) GPR119CCR5MEN1KMT2ASLC2A1
SCHEMBL4116869 0.91 TGFBR1 (0.44) GPR119CCR5MEN1KMT2ASLC2A1
SCHEMBL4123753 0.91 GPR119 (0.49) GPR119CCR5MEN1KMT2ASLC2A1
SCHEMBL4109003 0.90 MEN1 (0.50) GPR119MEN1KMT2ASLC2A1KDM1A
SCHEMBL4116013 0.90 GPR119 (0.51) GPR119MEN1KMT2ASLC2A1KDM1A
SCHEMBL4111226 0.89 KMT2A (0.47) GPR119MEN1KMT2ASLC2A1KDM1A
SCHEMBL4116057 0.89 USP30 (0.46) GPR119MEN1KMT2ASLC2A1KDM1A
SCHEMBL4132596 0.89 CCR5 (0.43) GPR119CCR5MEN1KMT2ASLC2A1
SCHEMBL4111166 0.89 MEN1 (0.50) GPR119MEN1KMT2ASLC2A1KDM1A
SCHEMBL4116027 0.88 GPR119 (0.44) GPR119MEN1KMT2ASLC2A1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
US-20060040986-A1 Erythropoietin production accelerator KOWA CO., LTD. (JP) 2006-02-23 US disclosed
EP-1568691-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR Kowa Co., Ltd. (JP) 2005-08-31 EP disclosed
US-20050176708-A1 Piperidine derivatives useful as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2005-08-11 US disclosed
US-20050176764-A1 Medicine for treating cancer KOWA CO., LTD (JP) 2005-08-11 US disclosed
US-6867221-B2 Cyclic amine compounds and pharmaceutical composition containing the same KOWA CO., LTD. (JP) 2005-03-15 US disclosed
EP-1494670-A1 MEDICINE FOR TREATING CANCER Kowa Co., Ltd. (JP) 2005-01-12 EP disclosed
EP-1422219-A1 CYCLIC AMINE COMPOUND Kowa Co., Ltd. (JP) 2004-05-26 EP disclosed
US-20040010147-A1 Cyclic amine compounds and pharmaceutical composition containing the same KOWA CO., LTD. (JP) 2004-01-15 US disclosed
WO-2003086397-A1 MEDICINE FOR TREATING CANCER KOWA CO., LTD. (JP) 2003-10-23 WO disclosed
US-6605620-B1 Such as 4-(N-(4-Methoxyphenyl)-N-(3-(3,4,5-trimethoxy-phenyl)-benzoylamino)-1-((2 -(3,4,5-trimethoxyphenyl)pyridin-4-yl)-methyl)piperidine; treatment and prevention of cell adhesion or infiltration KOWA CO., LTD. (JP) 2003-08-12 US 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 (5 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-20050176764-A1 Medicine for treating cancer HDAC4, HDAC3, NR4A3 GPR119 524/4885CCR5 1176/4885MEN1 4131/4885
US-20060040986-A1 Erythropoietin production accelerator EPOR, GHRHR, ARL1 GPR119 66/4885CCR5 1035/4885MEN1 4312/4885
US-20050176708-A1 Piperidine derivatives useful as modulators of chemokine receptor activity CCR3, CCR1, ACKR3 GPR119 260/4885CCR5 4/4885MEN1 4028/4885
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR EPOR, GHRHR, ARL1 GPR119 66/4885CCR5 1035/4885MEN1 4312/4885
US-20040010147-A1 Cyclic amine compounds and pharmaceutical composition containing the same HRH3, HRH4, CNKSR1 GPR119 676/4885CCR5 95/4885MEN1 3648/4885

“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.