SCHEMBL4114497

SCHEMBL4114497

COc1cc(-c2cc(CN(c3ccc(Br)cc3)C3CCN(C(=O)OC(C)(C)C)CC3)ccn2)cc(OC)c1OC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.42
KDM1A O60341 1/20 0.41
GPR119 Q8TDV5 11/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
CCR5 P51681 1/20 0.40
HDAC1 Q13547 1/20 0.39
CFTR P13569 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
SCHEMBL4109826 0.93 SLC2A1 (0.49) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4116600 0.93 MEN1 (0.44) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4122492 0.92 MEN1 (0.47) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4118634 0.92 MEN1 (0.47) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4111624 0.92 MEN1 (0.45) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4116673 0.91 SLC2A1 (0.43) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4122223 0.91 GPR119 (0.49) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4121708 0.91 GPR119 (0.42) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4121866 0.89 SLC2A1 (0.43) SLC2A1KDM1AGPR119MEN1KMT2A
SCHEMBL4122503 0.89 GPR119 (0.47) SLC2A1KDM1AGPR119MEN1KMT2A

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 12 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-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 (4 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 SLC2A1 1517/4885KDM1A 869/4885GPR119 524/4885
US-20060040986-A1 Erythropoietin production accelerator EPOR, GHRHR, ARL1 SLC2A1 3455/4885KDM1A 2622/4885GPR119 66/4885
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR EPOR, GHRHR, ARL1 SLC2A1 3455/4885KDM1A 2622/4885GPR119 66/4885
US-20040010147-A1 Cyclic amine compounds and pharmaceutical composition containing the same HRH3, HRH4, CNKSR1 SLC2A1 2240/4885KDM1A 3018/4885GPR119 676/4885

“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.