SCHEMBL2268091

SCHEMBL2268091

N[C@H](C=O)Cc1n[nH]c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
GAA P10253 2/20 0.44
PDPK1 O15530 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALDH1A1 P00352 3/20 0.42
TTK P33981 2/20 0.42
IDO1 P14902 2/20 0.42
ALPL P05186 1/20 0.42
HPGD P15428 1/20 0.42
MAPK10 P53779 1/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
TP53 P04637 1/20 0.41
CTNNB1 P35222 2/20 0.39
WNT3A P56704 2/20 0.39
CYP1A2 P05177 1/20 0.39
YTHDC1 Q96MU7 1/20 0.39
AURKA O14965 1/20 0.39
STAT3 P40763 1/20 0.39
HIF1A Q16665 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
SCHEMBL2268143 1.00 KDM4E (0.44) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL5989957 0.79 SLC6A2 (0.50) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL30166149 0.79 SLC6A2 (0.50) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL9727950 0.78 KDM4E (0.44) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL2268137 0.78 KDM4E (0.44) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL2268086 0.78 KDM4E (0.44) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL7416939 0.77 KDM4E (0.55) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL31642427 0.77 KDM4E (0.55) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL31646447 0.77 KDM4E (0.55) KDM4EGAAPDPK1CYP3A4ALDH1A1
SCHEMBL29353985 0.77 KDM4E (0.55) KDM4EGAAPDPK1CYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195898-A1 TREATMENT OF ALZHEIMER'S DISEASE AND MILD COGNITIVE IMPAIRMENT USING GNRH-I ANALOGS AND ONE OR MORE OF ACETYLCHOLINESTERASE INHIBITORS AND NMDA RECEPTOR ANTAGONISTS VOYAGER PHARMACEUTICAL CORPORATION (US) 2011-08-11 US claimed
US-20080171736-A1 Treatment of Alzheimer's Disease and Mild Cognitive impairment using GnRH-I analogs and one or more of acetylcholinesterase inhibitors and NMDA receptor antagonists VOYAGER PHARMACEUTICAL CORPORATION 2008-07-17 US claimed
EP-0417454-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1991-03-20 EP claimed
EP-0413209-A1 LHRH analogs TAP Pharmaceuticals Inc. (US) 1991-02-20 EP claimed
US-20110195898-A1 TREATMENT OF ALZHEIMER'S DISEASE AND MILD COGNITIVE IMPAIRMENT USING GNRH-I ANALOGS AND ONE OR MORE OF ACETYLCHOLINESTERASE INHIBITORS AND NMDA RECEPTOR ANTAGONISTS VOYAGER PHARMACEUTICAL CORPORATION (US) 2011-08-11 US disclosed
US-20080171736-A1 Treatment of Alzheimer's Disease and Mild Cognitive impairment using GnRH-I analogs and one or more of acetylcholinesterase inhibitors and NMDA receptor antagonists VOYAGER PHARMACEUTICAL CORPORATION 2008-07-17 US disclosed
US-5300492-A Suppressing levels of sex hormones in male or female mammals TAP PHARMACEUTICALS (US) 1994-04-05 US disclosed
US-5140009-A Stable against proteolytic enzymes; anticarcinogenic agents; urogenital disorders TAP PHARMACEUTICALS, INC. (US) 1992-08-18 US disclosed
US-5110904-A Luteinizing hormone releasing hormone; suppression of sex hormones ABBOTT LABORATORIES (US) 1992-05-05 US disclosed
EP-0417454-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1991-03-20 EP disclosed
EP-0413209-A1 LHRH analogs TAP Pharmaceuticals Inc. (US) 1991-02-20 EP 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 (2 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-20110195898-A1 TREATMENT OF ALZHEIMER'S DISEASE AND MILD COGNITIVE IMPAIRMENT USING GNRH-I ANALOGS AND ONE OR MORE OF ACETYLCHOLINESTERASE INHIBITORS AND NMDA RECEPTOR ANTAGONISTS GNRHR, GRIN1, GRIN3A KDM4E 1215/4885GAA 415/4885PDPK1 2159/4885
US-20080171736-A1 Treatment of Alzheimer's Disease and Mild Cognitive impairment using GnRH-I analogs and one or more of acetylcholinesterase inhibitors and NMDA receptor antagonists GNRHR, GRIN1, GRIN3A KDM4E 1215/4885GAA 415/4885PDPK1 2159/4885

“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.