SCHEMBL16099490

SCHEMBL16099490

N#Cc1ccc(-n2nncc2CO)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.59
NOTUM Q6P988 2/20 0.48
CYP11B2 P19099 3/20 0.46
CYP11B1 P15538 2/20 0.46
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
XDH P47989 1/20 0.38
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
CYP19A1 P11511 1/20 0.36
MAPK14 Q16539 1/20 0.36
PGR P06401 1/20 0.35
AR P10275 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL13509856 0.78 HSD11B1 (0.58) HSD11B1ALDH1A1
SCHEMBL16187820 0.75 HSD11B1 (0.47) HSD11B1NOTUMCYP11B2XDHIDO1
SCHEMBL18865728 0.75 TSHR (0.54) HSD11B1NOTUMCYP11B2CYP11B1XDH
SCHEMBL25043902 0.74 HSD11B1 (0.38) HSD11B1ALDH1A1MAPT
SCHEMBL16100377 0.74 HSD11B1 (0.46) HSD11B1NOTUMXDHIDO1TDO2
SCHEMBL20097513 0.73 ALDH1A1 (0.55) HSD11B1ALDH1A1
SCHEMBL16100223 0.72 CYP11B2 (0.61) NOTUMCYP11B2CYP11B1CYP19A1
SCHEMBL5924336 0.72 KMT2A (0.61) ALDH1A1MAPT
SCHEMBL4421821 0.72 PTGS2 (0.56) HSD11B1
SCHEMBL323458 0.71 NOTUM (0.51) HSD11B1NOTUMCYP11B2CYP11B1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190218194-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. 2019-07-18 US disclosed
US-20190218194-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. 2019-07-18 US disclosed
EP-3363434-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme Inc (US) 2018-08-22 EP disclosed
EP-2970131-B1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF EPIZYME INC (US) 2017-11-15 EP disclosed
EP-2970131-B1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF EPIZYME INC (US) 2017-11-15 EP disclosed
US-20170088529-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-03-30 US disclosed
US-20170088529-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-03-30 US disclosed
US-20170088529-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-03-30 US disclosed
US-9365527-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2016-06-14 US disclosed
US-9365527-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2016-06-14 US disclosed
US-9365527-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2016-06-14 US disclosed
US-20160031839-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-02-04 US disclosed
US-20160031839-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-02-04 US disclosed
US-20160031839-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-02-04 US disclosed
EP-2970131-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-01-20 EP disclosed
US-20140315961-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-10-23 US disclosed
US-20140315961-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-10-23 US disclosed
US-20140315961-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-10-23 US disclosed
WO-2014153100-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-09-25 WO disclosed
WO-2014153100-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-09-25 WO 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-20140315961-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HSD11B1 488/4885NOTUM 572/4885CYP11B2 244/4885
US-20160031839-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HSD11B1 488/4885NOTUM 572/4885CYP11B2 244/4885
US-20190218194-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HSD11B1 488/4885NOTUM 572/4885CYP11B2 244/4885
US-20170088529-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HSD11B1 488/4885NOTUM 572/4885CYP11B2 244/4885

“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.