SCHEMBL6092078

SCHEMBL6092078

O=C(C=CC12CC3CC(CC(C3)C1)C2)c1ccnc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
P2RX7 Q99572 4/20 0.42
FAP Q12884 2/20 0.41
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
HSP90AA1 P07900 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GAA P10253 1/20 0.37
PREP P48147 1/20 0.37
PITRM1 Q5JRX3 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL4728914 0.75 RAB9A (0.51) SMN1; SMN2P2RX7MAPTKDM4EALDH1A1
SCHEMBL4731777 0.75 RAB9A (0.51) SMN1; SMN2P2RX7MAPTKDM4EALDH1A1
SCHEMBL12783501 0.74 ALDH1A1 (0.44) SMN1; SMN2MAPTALDH1A1NPC1RAB9A
SCHEMBL6092524 0.73 P2RX7 (0.50) SMN1; SMN2P2RX7MAPTKDM4EALDH1A1
SCHEMBL6091141 0.72 FAAH (0.49) SMN1; SMN2P2RX7MAPTKDM4EALDH1A1
SCHEMBL4727008 0.72 CNR2 (0.46) SMN1; SMN2MAPTKDM4EALDH1A1NPC1
SCHEMBL4727194 0.72 CNR2 (0.46) SMN1; SMN2MAPTKDM4EALDH1A1NPC1
SCHEMBL27351674 0.72 PTPN1 (0.46) SMN1; SMN2MAPTALDH1A1NPC1RAB9A
SCHEMBL4729642 0.72 CNR2 (0.46) SMN1; SMN2P2RX7KDM4EALDH1A1HTT
SCHEMBL6482241 0.72 P2RX7 (0.58) SMN1; SMN2P2RX7FAPALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 US claimed
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 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 (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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders PMP22, ADCYAP1R1, CYP11B2 SMN1; SMN2 323/4885P2RX7 373/4885FAP 2074/4885

“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.