SCHEMBL6919592

SCHEMBL6919592

CC(=O)OCCn1ccc2ccc(OCc3ccccc3)cc21

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 1/20 0.57
▸ MCL1 Q07820 8/20 0.54
▸ BCL2 P10415 3/20 0.54
▸ MCHR1 Q99705 1/20 0.49
▸ SRD5A2 P31213 1/20 0.49
▸ MAOB P27338 1/20 0.49

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
SCHEMBL6099158 0.91 BCL2 (0.55) MCL1BCL2SRD5A2MAOB
SCHEMBL8303038 0.83 MCL1 (0.57) MCL1BCL2
SCHEMBL19149410 0.82 HTR7 (0.60) HTR7MCL1BCL2MCHR1SRD5A2
SCHEMBL19172461 0.82 HTR7 (0.65) HTR7MCL1BCL2MCHR1SRD5A2
SCHEMBL27619992 0.80 MCL1 (0.55) MCL1BCL2SRD5A2
SCHEMBL6724557 0.79 MTNR1A (0.46) MCL1BCL2
SCHEMBL23927885 0.79 HTR2A (0.66) HTR7MCL1BCL2MCHR1
SCHEMBL8163392 0.77 MAPK1 (0.60) —
SCHEMBL6089283 0.76 HTR7 (0.55) HTR7MCL1BCL2MCHR1SRD5A2
SCHEMBL6089075 0.76 HTR7 (0.55) HTR7MCL1BCL2MCHR1SRD5A2

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-20040214832-A1 Piperazine derivative renin inhibitors WARNER-LAMBERT COMPANY LLC 2004-10-28 — — 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-20040214832-A1 Piperazine derivative renin inhibitors REN, ACE, AGTR2 HTR7 1644/4885MCL1 4645/4885BCL2 4317/4885

“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.

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