SCHEMBL15294792

SCHEMBL15294792

CCOC(=O)C(=O)NC1CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.47
SMYD3 Q9H7B4 1/20 0.45
MAPT P10636 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
GAA P10253 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HTT P42858 1/20 0.40
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 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
SCHEMBL24485231 0.92 MAPT (0.48) EGLN1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL20827027 0.92 SMN1; SMN2 (0.54) MAPTSMN1; SMN2RAB9ANPC1GAA
SCHEMBL23207493 0.91 EPHX2 (0.41) EGLN1SMYD3MAPTSMN1; SMN2RAB9A
SCHEMBL11412912 0.90 SMN1; SMN2 (0.57) MAPTSMN1; SMN2RAB9ANPC1GAA
SCHEMBL9865762 0.90 SMN1; SMN2 (0.57) MAPTSMN1; SMN2RAB9ANPC1GAA
SCHEMBL6989749 0.87 EPHX1 (0.50) EGLN1SMYD3MAPTRAB9ANPC1
SCHEMBL24754980 0.84 EPHX2 (0.44) EGLN1SMYD3MAPTRAB9ANPC1
SCHEMBL10652333 0.82 SMYD3 (0.44) EGLN1SMYD3MAPTRAB9ANPC1
SCHEMBL18459805 0.80 ALDH1A1 (0.48) EGLN1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7788916 0.78 SMYD3 (0.47) SMYD3SMN1; SMN2GAAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109776522-B Substituted heteroaryl compounds, compositions and uses thereof 广东东阳光药业有限公司 2020-12-29 CN disclosed
EP-3710006-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE Sunshine Lake Pharma Co., Ltd. (CN) 2020-09-23 EP disclosed
US-10683297-B2 Substituted heteroaryl compounds and methods of use CALITOR SCIENCES, LLC (US) 2020-06-16 US disclosed
US-20190152977-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE Northern Industrial Area, (CN) 2019-05-23 US disclosed
US-9815832-B2 Azabenzimidazole compounds PFIZER INC. (US) 2017-11-14 US disclosed
EP-2958915-B1 AZABENZIMIDAZOLE COMPOUNDS AS INHIBITORS OF PDE4 ISOZYMES FOR THE TREATMENT OF CNS AND OTHER DISORDERS PFIZER (US) 2017-07-05 EP disclosed
US-20150322065-A1 Azabenzimidazole Compounds PFIZER (US) 2015-11-12 US disclosed
US-9120788-B2 Azabenzimidazole compounds PFIZER INC. (US) 2015-09-01 US disclosed
US-9120788-B2 Azabenzimidazole compounds PFIZER INC. (US) 2015-09-01 US disclosed
US-20150051203-A1 TRIAZOLE DERIVATIVES AS HSP90 INHIBITORS SYNTA PHARMACEUTICALS CORP. 2015-02-19 US disclosed
WO-2014128585-A1 AZABENZIMIDAZOLE COMPOUNDS AS INHIBITORS OF PDE4 ISOZYMES FOR THE TREATMENT OF CNS AND OTHER DISORDERS PFIZER INC. (US) 2014-08-28 WO disclosed
US-20140235612-A1 Azabenzimidazole Compounds PFIZER (US) 2014-08-21 US disclosed
US-20140235612-A1 Azabenzimidazole Compounds PFIZER (US) 2014-08-21 US disclosed
WO-2013148857-A1 TRIAZOLE DERIVATIVES AS HSP90 INHIBITORS SYNTA PHARMACEUTICALS CORP. (US) 2013-10-03 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 (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-20150051203-A1 TRIAZOLE DERIVATIVES AS HSP90 INHIBITORS HSP90AB1, HSP90AA1, HSP90AB2P EGLN1 942/4885SMYD3 4136/4885MAPT 233/4885
US-20150322065-A1 Azabenzimidazole Compounds AZI2, HDAC6, ABL1 EGLN1 3161/4885SMYD3 860/4885MAPT 4007/4885
US-20190152977-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE PRKACA, PRKDC, PRKACB EGLN1 3664/4885SMYD3 3190/4885MAPT 2017/4885
US-10683297-B2 Substituted heteroaryl compounds and methods of use PRKACA, PRKDC, PRKACB EGLN1 3664/4885SMYD3 3190/4885MAPT 2017/4885
US-20140235612-A1 Azabenzimidazole Compounds AZI2, HDAC6, ABL1 EGLN1 3161/4885SMYD3 860/4885MAPT 4007/4885

“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.