SCHEMBL27002124

SCHEMBL27002124

CCC(N)Cc1cc(OC)c(SCCCCF)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 4/20 0.43
▸ HTR2C P28335 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ SLC6A4 P31645 2/20 0.36
▸ SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL27002104 0.88 SIGMAR1 (0.39) HTR2ASLC6A4SIGMAR1
SCHEMBL27002196 0.85 HTR2A (0.37) HTR2AHTR2CHTR2BSLC6A4SIGMAR1
SCHEMBL30730987 0.81 HTR2A (0.47) HTR2AHTR2CHTR2B
SCHEMBL27002187 0.79 HTR2A (0.58) HTR2AHTR2CHTR2B
SCHEMBL29279553 0.79 SLC6A4 (0.36) HTR2ASLC6A4SIGMAR1
SCHEMBL27002101 0.78 HTR2A (0.57) HTR2AHTR2CHTR2B
SCHEMBL27002153 0.76 HTR2A (0.65) HTR2AHTR2CHTR2B
SCHEMBL5293465 0.75 MAOA (0.54) HTR2A
SCHEMBL26056043 0.75 HTR2A (0.59) HTR2AHTR2CHTR2B
SCHEMBL20970858 0.72 PTGS2 (0.57) HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166618-A1 PHENALKYLAMINES AND METHODS OF MAKING AND USING THE SAME GILGAMESH PHARMACEUTICALS, INC. (US) 2024-05-23 — — US disclosed
CN-117642379-A Phenylalkylamines and methods of making and using the same 吉尔伽美什制药公司 2024-03-01 — — CN disclosed
EP-4305019-A1 PHENALKYLAMINES AND METHODS OF MAKING AND USING THE SAME Gilgamesh Pharmaceuticals, Inc. (US) 2024-01-17 — — EP disclosed
WO-2022192781-A1 PHENALKYLAMINES AND METHODS OF MAKING AND USING THE SAME GILGAMESH PHARMACEUTICALS, INC. (US) 2022-09-15 — — WO 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-20240166618-A1 PHENALKYLAMINES AND METHODS OF MAKING AND USING THE SAME PNMT, HTR6, HTR2C HTR2A 11/4885HTR2C 3/4885HTR2B 23/4885

“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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