SCHEMBL27002138

SCHEMBL27002138

COc1cc(CCN)cc(OC)c1SCCCC(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 15/20 0.61
▸ HTR2C P28335 9/20 0.50
▸ HTR2B P41595 8/20 0.50
▸ KDM4E B2RXH2 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ TAAR1 Q96RJ0 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ NFKB1 P19838 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
SCHEMBL27002059 0.96 HTR2A (0.59) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL26056042 0.92 HTR2A (0.64) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL26056043 0.85 HTR2A (0.59) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL27002187 0.84 HTR2A (0.58) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL27002101 0.83 HTR2A (0.57) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL20970965 0.82 HTR2A (0.55) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL27002131 0.81 HTR2A (0.54) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL27002147 0.80 HTR2A (0.52) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL20970884 0.79 HTR2A (0.58) HTR2AHTR2CHTR2BKDM4EATM
SCHEMBL27002196 0.79 HTR2A (0.37) 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 3 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
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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