SCHEMBL4810186

SCHEMBL4810186

O=C(O)c1cc2c(ccc3[nH]ncc32)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.55
HSD17B10 Q99714 4/20 0.55
ALDH1A1 P00352 3/20 0.55
LMNA P02545 3/20 0.55
IDO1 P14902 1/20 0.50
TDO2 P48775 1/20 0.50
NGFR P08138 1/20 0.46
HPGD P15428 4/20 0.46
CYP2C19 P33261 2/20 0.46
GRIN1 Q05586 2/20 0.46
GPR35 Q9HC97 2/20 0.46
MEN1 O00255 2/20 0.46
MAPK1 P28482 2/20 0.46
KMT2A Q03164 2/20 0.46
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
CYP1A2 P05177 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
AHR P35869 1/20 0.46

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
SCHEMBL4810421 0.80 HSD17B10 (0.55) KDM4EHSD17B10ALDH1A1LMNAIDO1
SCHEMBL4816461 0.78 KDM4E (0.53) KDM4EHSD17B10ALDH1A1LMNAHPGD
SCHEMBL12321248 0.73 NOS1 (0.56) KDM4EALDH1A1IDO1TDO2HPGD
SCHEMBL4661897 0.72 KDM4E (0.58) KDM4EHSD17B10ALDH1A1LMNANGFR
SCHEMBL8062076 0.72 CCNA2 (0.43) HSD17B10ALDH1A1LMNAIDO1HPGD
SCHEMBL1600742 0.71 CCNA2 (0.42) IDO1TDO2MAPK1CCNA2CDK2
SCHEMBL3601642 0.71 HSD17B10 (1.00) KDM4EHSD17B10ALDH1A1LMNANGFR
SCHEMBL29705820 0.71 NOS1 (0.49) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL21793858 0.71 CCNA2 (0.42) IDO1MAPK1CCNA2CDK2CCNA1
SCHEMBL5446861 0.71 CCNA2 (0.42) ALDH1A1LMNAHPGDCYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378431-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-05-27 US disclosed
US-7375116-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-05-20 US disclosed
US-7365083-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-04-29 US disclosed
US-7361670-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-04-22 US disclosed
US-20050159451-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-07-21 US disclosed
US-6919355-B2 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2005-07-19 US disclosed
US-20050113359-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-05-26 US disclosed
US-20050113361-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-05-26 US disclosed
US-20050113360-A1 Amide derivatives as NMDA receptor antagonists HORVATH CSILLA (HU) 2005-05-26 US disclosed
US-20030199552-A1 Amide derivatives as NMDA receptor antagonists RICHTER GEDEON VEGYESZETI GYAR RT. 2003-10-23 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-20050113361-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B KDM4E 934/4885HSD17B10 2276/4885ALDH1A1 3399/4885
US-20050113360-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B KDM4E 1346/4885HSD17B10 3018/4885ALDH1A1 3195/4885
US-20050159451-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B KDM4E 1242/4885HSD17B10 2802/4885ALDH1A1 3627/4885
US-20050113359-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2B KDM4E 885/4885HSD17B10 2200/4885ALDH1A1 3307/4885
US-20030199552-A1 Amide derivatives as NMDA receptor antagonists GRIN1, GRIN3A, GRIN2C KDM4E 1215/4885HSD17B10 1810/4885ALDH1A1 1852/4885

“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.