SCHEMBL22210606

SCHEMBL22210606

CCOC(O)C1CCCc2c1c1c(OC)ccc(Cl)c1n2CCOCc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.33
TSPO P30536 2/20 0.33
TACR1 P25103 1/20 0.33
PDE4B Q07343 1/20 0.31
HTR6 P50406 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
TEAD3 Q99594 1/20 0.31
HRH2 P25021 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 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
SCHEMBL416598 0.82 TSPO (0.42) LTA4HTSPOTACR1TEAD3HCRTR1
SCHEMBL420135 0.82 TSPO (0.41) TSPO
SCHEMBL28254010 0.82 HTR6 (0.38) LTA4HTSPOHTR6SIGMAR1TEAD3
SCHEMBL416578 0.81 TSPO (0.42) TSPOTACR1TEAD3HCRTR1HCRTR2
SCHEMBL460215 0.80 TSPO (0.56) TSPO
SCHEMBL6688729 0.71 TSPO (0.43) TSPOHTR6HCRTR1HCRTR2
SCHEMBL6693579 0.71 FABP4 (0.44) TSPOHTR6HCRTR1HCRTR2
SCHEMBL12748236 0.71 TSPO (0.44) TSPO
SCHEMBL12748241 0.71 TSPO (0.44) TSPO
SCHEMBL12748249 0.70 TSPO (0.43) TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10709798-B2 Crystallization process of tricyclic indole derivatives GE HEALTHCARE LIMITED (GB) 2020-07-14 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-10709798-B2 Crystallization process of tricyclic indole derivatives IDO1, IDO2, TPH1 LTA4H 3561/4885TSPO 3643/4885TACR1 1366/4885

“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.