SCHEMBL25846134

SCHEMBL25846134

Cn1c2c(c3cccnc31)CCN(C1CCC1)CC2

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.49
HRH3 Q9Y5N1 6/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
HTR6 P50406 3/20 0.38
HRH1 P35367 4/20 0.37
ENPP2 Q13822 1/20 0.37
KDM4E B2RXH2 1/20 0.36
RAD52 P43351 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FEN1 P39748 1/20 0.35
CNR1 P21554 1/20 0.35

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
SCHEMBL30339453 0.86 MCHR1 (0.38) MCHR1FEN1
SCHEMBL24101666 0.86 MCHR1 (0.38) MCHR1FEN1
SCHEMBL30339398 0.82 CYP1A2 (0.44) MCHR1DDB1CRBNHTR6HRH1
SCHEMBL24101726 0.82 CYP1A2 (0.44) MCHR1DDB1CRBNHTR6HRH1
SCHEMBL25846111 0.80 MCHR1 (0.52) MCHR1HRH3HTR6CNR1
SCHEMBL968695 0.78 PARP1 (0.47) MCHR1ENPP2KDM4E
SCHEMBL25846131 0.78 DDB1 (0.48) HRH3DDB1CRBNHTR6HRH1
SCHEMBL25846151 0.78 MCHR1 (0.44) MCHR1HRH3HTR6HRH1CNR1
SCHEMBL26017344 0.74 DDB1 (0.46) DDB1CRBNHTR6HRH1ENPP2
SCHEMBL24101662 0.72 HTR2A (0.59) MCHR1DDB1CRBNHTR6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227453-A1 TRICYCLIC PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-20 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 (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-20230227453-A1 TRICYCLIC PSYCHOPLASTOGENS AND USES THEREOF GAP43, GRIN2A, GRIN2C MCHR1 320/4885HRH3 1112/4885DDB1 2175/4885

“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.