SCHEMBL7217002

SCHEMBL7217002

CCC1=CCc2ccccc2O1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.45
MAOB P27338 1/20 0.45
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 1/20 0.36
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.32
P2RX4 Q99571 1/20 0.31
OXTR P30559 1/20 0.31
HSD17B3 P37058 1/20 0.30
MEN1 O00255 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL10645704 0.87 MAOA (0.41) MAOAMAOBNPSR1GAANPC1
SCHEMBL9935109 0.86 MAOA (0.43) MAOAMAOBNPSR1GAANPC1
SCHEMBL27731586 0.83 MAOA (0.37) MAOAMAOBMEN1KMT2A
SCHEMBL3626527 0.82 MAOA (0.43) MAOAMAOBNPSR1GAANPC1
SCHEMBL295051 0.82 MAOA (0.43) MAOAMAOBNPSR1GAANPC1
SCHEMBL4206535 0.82 MAOA (0.43) MAOAMAOBNPSR1GAANPC1
SCHEMBL9773035 0.79 MAOA (0.41) MAOAMAOBNPSR1GAANPC1
SCHEMBL295013 0.79 MAOA (0.41) MAOAMAOBNPSR1GAANPC1
SCHEMBL8972473 0.78 MAOA (0.39) MAOAMAOBNPSR1GAA
SCHEMBL6007613 0.78 MAOA (0.36) MAOAMAOBNPSR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6576765-B2 Process for preparing amic acid esters IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2003-06-10 US disclosed
US-20030032667-A1 PROCESS FOR PREPARING AMIC ACID ESTERS IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2003-02-13 US disclosed
EP-1182199-A1 PROCESS FOR PREPARING AMIC ACID ESTERS IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2002-02-27 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 (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-20030032667-A1 PROCESS FOR PREPARING AMIC ACID ESTERS MCCC2, EMC1, GANC MAOA 656/4885MAOB 779/4885NPSR1 4196/4885

“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.