SCHEMBL5767302

SCHEMBL5767302

O=C1c2ccccc2-c2c(CCNC3CC3)c3cc(F)ccc3n21

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 1/20 0.40
▸ MTNR1A P48039 4/20 0.35
▸ MTNR1B P49286 4/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ OPRM1 P35372 2/20 0.35
▸ OPRL1 P41146 2/20 0.35
▸ PER2 O15055 1/20 0.34
▸ CRY2 Q49AN0 1/20 0.34
▸ ACHE P22303 4/20 0.34

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
SCHEMBL5095599 0.79 TACR1 (0.41) TACR1PER2CRY2
SCHEMBL28888365 0.78 TACR1 (0.41) TACR1PER2CRY2ACHE
SCHEMBL5094690 0.77 HTR6 (0.44) TACR1PER2CRY2
Hydrochloric Acid SCHEMBL5094866 0.76 HTR6 (0.43) TACR1PER2CRY2
Oxalic Acid SCHEMBL5094982 0.73 TACR1 (0.43) TACR1
Maleic Acid SCHEMBL5094863 0.71 TACR1 (0.42) TACR1
SCHEMBL28395787 0.71 KMT2A (0.40) TACR1PER2CRY2
Citric Acid SCHEMBL5101053 0.68 TACR1 (0.41) TACR1
SCHEMBL5094719 0.65 TACR1 (0.52) TACR1
SCHEMBL5094694 0.65 PER2 (0.35) TACR1PER2CRY2

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
EP-1517909-B1 NOVEL TETRACYCLIC ARYLCARBONYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY USEFUL AS THERAPEUTIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SUVEN LIFE SCIENCES LTD (IN) 2006-10-25 — — EP claimed
US-20050250834-A1 Novel tetracyclic arylcarbonyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical composition containing them SUVEN LIFE SCIENCES LIMITED (IN) 2005-11-10 — — US claimed

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-20050250834-A1 Novel tetracyclic arylcarbonyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical composition containing them TPH1, HTR1A, HTR5A TACR1 74/4885MTNR1A 54/4885MTNR1B 73/4885

“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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