SCHEMBL22320203

SCHEMBL22320203

C[CH]C(C)n1ccc2cc(Br)ccc21

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
SLC6A2 P23975 4/20 0.40
SLC6A4 P31645 2/20 0.40
NTSR1 P30989 1/20 0.38
ROCK1 Q13464 1/20 0.36
HTR7 P34969 3/20 0.36
MCL1 Q07820 1/20 0.34
CYP2A6 P11509 1/20 0.33
FABP4 P15090 2/20 0.33
KRAS P01116 3/20 0.32
FABP3 P05413 1/20 0.32
FABP2 P12104 1/20 0.32
FABP5 Q01469 1/20 0.32
PDE4B Q07343 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
SCHEMBL15712255 0.82 HTR2A (0.54) HTR2AHTR2CSLC6A2SLC6A4NTSR1
SCHEMBL30861517 0.82 HTR2A (0.54) HTR2AHTR2CSLC6A2SLC6A4NTSR1
SCHEMBL20876078 0.80 HTR2C (0.49) HTR2AHTR2CSLC6A2SLC6A4CYP2A6
SCHEMBL20876045 0.80 HTR2A (0.49) HTR2AHTR2CSLC6A2SLC6A4CYP2A6
SCHEMBL22320201 0.76 HTR2A (0.37) HTR2AHTR2C
SCHEMBL22320205 0.76 CDC7 (0.40) CYP2A6
SCHEMBL30861604 0.75 HTR2A (0.46) HTR2AHTR2CSLC6A2SLC6A4NTSR1
SCHEMBL22320222 0.75 HTR2A (0.37) HTR2AHTR2C
SCHEMBL16627457 0.74 HTR2A (0.47) HTR2AHTR2CSLC6A2SLC6A4NTSR1
SCHEMBL22798848 0.74 NTSR1 (0.50) HTR2AHTR2CSLC6A2SLC6A4NTSR1

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-11629138-B2 Microbiocidal picolinamide derivatives SYNGENTA PARTICIPATIONS AG (CH) 2023-04-18 US disclosed
EP-3692029-B1 MICROBIOCIDAL PICOLINAMIDE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2023-04-12 EP disclosed
US-20200255400-A1 Microbiocidal Picolinamide Derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-08-13 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 (2 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-20200255400-A1 Microbiocidal Picolinamide Derivatives PRF1, CASP1, FPR1 HTR2A 1946/4885HTR2C 2046/4885SLC6A2 3920/4885
US-11629138-B2 Microbiocidal picolinamide derivatives PRF1, CASP1, FPR1 HTR2A 1946/4885HTR2C 2046/4885SLC6A2 3920/4885

“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.