SCHEMBL24110322

SCHEMBL24110322

Cc1cccc2c1ccn2CC1(N(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.50
HTR2A P28223 3/20 0.50
P2RX7 Q99572 1/20 0.41
PRMT5 O14744 1/20 0.41
HTR6 P50406 2/20 0.38
FABP4 P15090 2/20 0.34
TRPM5 Q9NZQ8 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
THRB P10828 1/20 0.30
BCHE P06276 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL24110426 0.85 HTR2C (0.52) HTR2CHTR2AP2RX7PRMT5HTR6
SCHEMBL24110621 0.82 KRAS (0.32) HTR2CHTR2AHTR6
SCHEMBL24110433 0.81 HTR2C (0.53) HTR2CHTR2APRMT5HTR6FABP4
SCHEMBL24110205 0.79 HTR2A (0.32) HTR2CHTR2A
SCHEMBL24110421 0.77
SCHEMBL24110194 0.77 HTR2A (0.36) HTR2CHTR2A
SCHEMBL24110430 0.76 HTR2A (0.54) HTR2CHTR2AHTR6KMT2A
SCHEMBL24110201 0.76 ADRA2A (0.48) HTR2CHTR2AP2RX7THRB
SCHEMBL24110193 0.75 HTR2C (0.37) HTR2CHTR2A
SCHEMBL24110503 0.74 HTR2A (0.38) HTR2CHTR2A

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 HTR2C 35/4885HTR2A 10/4885P2RX7 1560/4885

“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.