SCHEMBL31411486

SCHEMBL31411486

COc1ccc2[nH]nc(I)c2c1F

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.40
HTR7 P34969 2/20 0.40
HTR6 P50406 2/20 0.40
NTRK1 P04629 7/20 0.34
MAPK8 P45983 1/20 0.34
GRM4 Q14833 2/20 0.33
HTR2A P28223 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
CYP2C9 P11712 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
MAPK10 P53779 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TTK P33981 1/20 0.32

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
SCHEMBL16675985 0.80 HTR1A (0.43) HTR1AHTR7HTR6NTRK1MAPK8
SCHEMBL30713502 0.79 ALOX5AP (0.32)
SCHEMBL31411331 0.77 GPR84 (0.39) HTR7HTR6NTRK1MAPK8GRM4
SCHEMBL31411291 0.77 GRM4 (0.33) GRM4
SCHEMBL14631557 0.76 HTR2A (0.50) HTR6MAPK8HTR2AMAPK10TTK
SCHEMBL1967068 0.75 PRKAA1 (0.46) HTR1AHTR7HTR6NTRK1LMNA
SCHEMBL20764903 0.74 HTR1A (0.35) HTR1AHTR7HTR6
SCHEMBL14631436 0.74 GAA (0.37) HTR1AHTR7HTR6GRM4
SCHEMBL31411308 0.73 MAPT (0.35) GRM4LMNARAB9AMAPK10SMN1; SMN2
SCHEMBL31411324 0.73 F10 (0.34) NTRK1MAPK8GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735425-A1 COMPOUNDS Psylo Pty Ltd (AU) 2026-05-06 EP disclosed
US-20250353818-A1 Compounds Psylo Pty Ltd (AU) 2025-11-20 US disclosed
US-12428380-B2 Compounds Psylo Pty Ltd (AU) 2025-09-30 US disclosed
US-20250214943-A1 Compounds Psylo Pty Ltd (AU) 2025-07-03 US disclosed
WO-2025000053-A1 COMPOUNDS Psylo Pty Ltd (AU) 2025-01-02 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 (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-20250214943-A1 Compounds NLN, SLC18A2, PYGB HTR1A 185/4885HTR7 192/4885HTR6 54/4885
US-12428380-B2 Compounds NLN, SLC18A2, PYGB HTR1A 185/4885HTR7 192/4885HTR6 54/4885
US-20250353818-A1 Compounds NLN, SLC18A2, PYGB HTR1A 185/4885HTR7 192/4885HTR6 54/4885

“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.