SCHEMBL26599490

SCHEMBL26599490

CCC(O)c1cccc(C#N)c1F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.41
ADRA2B P18089 3/20 0.41
ADRA2C P18825 2/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
PDE2A O00408 1/20 0.37
LMNA P02545 1/20 0.36
NOTUM Q6P988 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
TSHR P16473 2/20 0.33
PGR P06401 1/20 0.33
PDK2 Q15119 1/20 0.32
AR P10275 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HTR1A P08908 1/20 0.31
MAOA P21397 1/20 0.31
HTR2B P41595 1/20 0.31
ADRA1A P35348 1/20 0.31

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
SCHEMBL15687494 0.87 ADRA2A (0.39) ADRA2AADRA2BADRA2CADRB1ADRB3
SCHEMBL15687466 0.86 L3MBTL1 (0.42) ADRA2AADRA2BADRA2CADRB1ADRB3
SCHEMBL15687675 0.84 ADRB1 (0.39) ADRA2AADRA2BADRA2CADRB1ADRB3
SCHEMBL15687467 0.81 PDE2A (0.37) ADRA2AADRA2BADRA2CADRB1ADRB3
SCHEMBL12523256 0.81 TSHR (0.43) NOTUML3MBTL1TSHRARALDH1A1
SCHEMBL15687492 0.81 NOTUM (0.34) ADRB1NOTUML3MBTL1TSHRALDH1A1
SCHEMBL9821254 0.80 ADRB1 (0.54) ADRA2AADRA2BADRA2CADRB1ADRB3
SCHEMBL9821038 0.79 ADRB2 (0.51) ADRA2AADRA2BADRA2CADRB1ADRB3
SCHEMBL9003991 0.77 GABRA1 (0.40) LMNANOTUML3MBTL1TSHRAR
SCHEMBL954835 0.77 CES2 (0.47) ADRA2AADRA2BADRA2CADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250339402-A1 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FUNDAMENTAL PHARMA GMBH (DE) 2025-11-06 US disclosed
EP-4511355-A2 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FundaMental Pharma GmbH (DE) 2025-02-26 EP disclosed
CN-119522208-A Effective methods for modulating NMDA receptor-mediated toxicity 智基药业有限公司 2025-02-25 CN disclosed
WO-2024223617-A1 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FUNDAMENTAL PHARMA GMBH (DE) 2024-10-31 WO disclosed
WO-2023203254-A2 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FUNDAMENTAL PHARMA GMBH (DE) 2023-10-26 WO disclosed
WO-2023203254-A2 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FUNDAMENTAL PHARMA GMBH (DE) 2023-10-26 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 (1 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-20250339402-A1 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY TRPM4, GRM4, GRIN1 ADRA2A 1777/4885ADRA2B 1418/4885ADRA2C 1535/4885

“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.