SCHEMBL26288708

SCHEMBL26288708

COc1ccccc1N1CCNC[C@H]1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.58
HTR6 P50406 3/20 0.58
HTR3A P46098 2/20 0.58
DRD3 P35462 2/20 0.58
HTR3E A5X5Y0 1/20 0.58
HTR3B O95264 1/20 0.58
ADRB1 P08588 1/20 0.58
CYP2C19 P33261 1/20 0.58
HTR3D Q70Z44 1/20 0.58
HTR3C Q8WXA8 1/20 0.58
SIGMAR1 Q99720 1/20 0.58
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
BRPF1 P55201 3/20 0.52
BRD1 O95696 2/20 0.52
BRD4 O60885 1/20 0.52
BRPF3 Q9ULD4 1/20 0.52
HTR7 P34969 2/20 0.49
HTR2C P28335 8/20 0.48
HTR2B P41595 4/20 0.48

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
SCHEMBL25407437 1.00 DRD2 (0.58) DRD2HTR6HTR3ADRD3HTR3E
SCHEMBL26288599 1.00 DRD2 (0.58) DRD2HTR6HTR3ADRD3HTR3E
SCHEMBL21461788 0.87 HTR2C (0.48) DRD2HTR6HTR3ADRD3HTR3E
SCHEMBL19709338 0.87 HTR2C (0.48) DRD2HTR6HTR3ADRD3HTR3E
SCHEMBL8911452 0.84 DRD2 (0.56) DRD2HTR6HTR3ADRD3HTR3E
SCHEMBL30506635 0.84 DRD2 (0.56) DRD2HTR6HTR3ADRD3HTR3E
SCHEMBL21359240 0.83 HTR2C (0.47) DRD2HTR6BRPF1BRD1BRD4
SCHEMBL19709331 0.83 HTR2C (0.47) DRD2HTR6BRPF1BRD1BRD4
SCHEMBL21359242 0.83 HTR2C (0.47) DRD2HTR6BRPF1BRD1BRD4
SCHEMBL30952461 0.83 HTR2C (0.47) DRD2HTR6BRPF1BRD1BRD4

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-20230279008-A1 PTGR2 INHIBITORS AND THEIR USE NATIONAL TAIWAN UNIVERSITY (TW) 2023-09-07 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-20230279008-A1 PTGR2 INHIBITORS AND THEIR USE PTGFR, PTGIR, PTGDR2 DRD2 924/4885HTR6 527/4885HTR3A 591/4885

“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.