SCHEMBL29454352

SCHEMBL29454352

Cc1c(N)cc(F)cc1Cc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.41
TAAR1 Q96RJ0 3/20 0.41
ADCY10 Q96PN6 1/20 0.39
IDO1 P14902 2/20 0.39
AOC3 Q16853 1/20 0.39
DAO P14920 1/20 0.37
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
ADORA2A P29274 1/20 0.36

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
SCHEMBL22231703 1.00 MPO (0.41) MPOTAAR1ADCY10IDO1AOC3
SCHEMBL22232087 0.86 TAAR1 (0.40) MPOTAAR1ALDH1A1SLC6A2SLC6A4
SCHEMBL22232123 0.86 MPO (0.41) MPOTAAR1ADCY10IDO1AOC3
SCHEMBL29454251 0.85 DHFR (0.42) TAAR1IDO1ALDH1A1SLC6A2SLC6A4
SCHEMBL22231837 0.83 CYP1A2 (0.44) MPOTAAR1ADCY10IDO1AOC3
SCHEMBL29454276 0.83 PNMT (0.40) MPOTAAR1ADCY10IDO1AOC3
SCHEMBL22232679 0.83 PNMT (0.40) MPOTAAR1ADCY10IDO1AOC3
SCHEMBL29454268 0.81 IDO1 (0.39) MPOTAAR1ADCY10IDO1NPC1
SCHEMBL22231903 0.81 IDO1 (0.39) MPOTAAR1ADCY10IDO1NPC1
SCHEMBL22231824 0.81 IDO1 (0.42) IDO1ALDH1A1L3MBTL1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545639-B2 3-substituted phenylamidine compounds, preparation and use thereof PI INDUSTRIES LTD. (IN) 2026-02-10 US disclosed
US-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2022-03-24 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-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF H1-3, PRMT7, PFAS MPO 1451/4885TAAR1 1374/4885ADCY10 2371/4885
US-12545639-B2 3-substituted phenylamidine compounds, preparation and use thereof CBR1, CBR3, HCCS MPO 2443/4885TAAR1 445/4885ADCY10 2564/4885

“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.