SCHEMBL24243767

SCHEMBL24243767

CCCN(CC)CCc1c[nH]c2ccc(OC(C)=O)cc12

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 10/20 0.72
HTR1A P08908 5/20 0.65
HTR2A P28223 3/20 0.63
HTR1B P28222 6/20 0.63
CYP1A2 P05177 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
HSD17B10 Q99714 1/20 0.60

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
SCHEMBL30630383 0.95 HTR1D (0.76) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL23069144 0.95 HTR1D (0.76) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL30630375 0.94 HTR1D (0.77) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL23083090 0.94 HTR1D (0.77) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL30630301 0.91 HTR1B (0.67) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL30630357 0.91 HTR1D (0.77) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL27085054 0.91 HTR1B (0.67) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL27084708 0.91 HTR1D (0.77) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL24243678 0.91 HTR1D (0.59) HTR1DHTR1AHTR2AHTR1BCYP1A2
SCHEMBL30630363 0.91 HTR1D (0.59) HTR1DHTR1AHTR2AHTR1BCYP1A2

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-20240043382-A1 MODIFIED INDOLE ALKALOIDS FOR THERAPEUTIC USES COMPASS PATHFINDER LIMITED (GB) 2024-02-08 US disclosed
CN-117120415-A Modified indole alkaloids for therapeutic use 指南针探路者有限公司 2023-11-24 CN disclosed
US-20220241243-A1 METHODS OF TREATING MOOD DISORDERS GILGAMESH PHARMACEUTICALS, INC. 2022-08-04 US disclosed
US-20220041551-A1 METHODS OF TREATING MOOD DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2022-02-10 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 (3 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-20220041551-A1 METHODS OF TREATING MOOD DISORDERS GRIN2C, GRIN2A, TPH2 HTR1D 53/4885HTR1A 23/4885HTR2A 5/4885
US-20220241243-A1 METHODS OF TREATING MOOD DISORDERS GRIN2C, GRIN2A, TPH2 HTR1D 53/4885HTR1A 23/4885HTR2A 5/4885
US-20240043382-A1 MODIFIED INDOLE ALKALOIDS FOR THERAPEUTIC USES INMT, AANAT, HNMT HTR1D 664/4885HTR1A 181/4885HTR2A 53/4885

“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.