SCHEMBL24110503

SCHEMBL24110503

Cc1cc2ccn(CC3(N(C)C)CC3)c2cc1C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.38
HTR2C P28335 7/20 0.38
HTR1D P28221 5/20 0.34
KRAS P01116 2/20 0.34
HTR7 P34969 2/20 0.33
PTGER3 P43115 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL24110431 0.88 HTR2C (0.47) HTR2AHTR2CHTR1DKRASHTR7
SCHEMBL24110425 0.88 HTR2C (0.47) HTR2AHTR2CHTR1DHTR7
SCHEMBL24110504 0.86 HTR2C (0.36) HTR2AHTR2CHTR1DKRASHTR7
SCHEMBL24110500 0.86 HTR2C (0.36) HTR2AHTR2CHTR1DHTR7
SCHEMBL24110274 0.83 HTR2C (0.50) HTR2AHTR2CHTR7
SCHEMBL24110296 0.83 HTR2A (0.50) HTR2AHTR2CHTR1DHTR7
SCHEMBL24110427 0.83 HTR2C (0.57) HTR2AHTR2CHTR1DHTR7
SCHEMBL24110498 0.81 HTR2C (0.39) HTR2AHTR2CHTR1DHTR7
SCHEMBL24110434 0.79 HTR2C (0.51) HTR2AHTR2CHTR1DHTR7
SCHEMBL24110430 0.78 HTR2A (0.54) HTR2AHTR2CTSHRMAPK1SMN1; SMN2

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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
WO-2021252692-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2021-12-16 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT HTR2A 10/4885HTR2C 35/4885HTR1D 47/4885

“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.