SCHEMBL25975554

SCHEMBL25975554

Cc1nn(CCC(C)(F)C(F)(F)F)c2ncc(F)cc12

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SPR P35270 3/20 0.42
GUCY1A1 Q02108 3/20 0.33
GUCY1B1 Q02153 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CCR2 P41597 1/20 0.32
CCR5 P51681 1/20 0.32
HTR3A P46098 4/20 0.32
ADORA2A P29274 2/20 0.32
ADORA2B P29275 2/20 0.32
TNK2 Q07912 1/20 0.32
PDE10A Q9Y233 1/20 0.32
AR P10275 1/20 0.32
PDE5A O76074 1/20 0.30
CYP1A2 P05177 1/20 0.30
METAP2 P50579 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL25974820 0.90 SPR (0.42) SPRGUCY1A1GUCY1B1L3MBTL1CCR2
SCHEMBL19158836 0.89 SPR (0.42) SPRGUCY1A1GUCY1B1L3MBTL1CCR2
SCHEMBL19264146 0.75 L3MBTL1 (0.46) SPRL3MBTL1PDE10APDE5A
SCHEMBL19264342 0.74 L3MBTL1 (0.42) SPRL3MBTL1PDE5ACYP1A2
SCHEMBL326986 0.73 GUCY1A1 (0.38) GUCY1A1GUCY1B1HTR3APDE5A
SCHEMBL16167735 0.73 SPR (0.52) SPRCCR2CCR5ADORA2AADORA2B
SCHEMBL19264147 0.71 SPR (0.38) SPRL3MBTL1ADORA2AADORA2BPDE5A
SCHEMBL25975320 0.71 GUCY1A1 (0.41) SPRGUCY1A1GUCY1B1HTR3A
SCHEMBL25975200 0.70 GUCY1A1 (0.53) GUCY1A1GUCY1B1PDE5A
SCHEMBL25975201 0.70 GUCY1A1 (0.53) GUCY1A1GUCY1B1PDE5A

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-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF CHIA TAL TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-17 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-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF TYMP, TYMS, DPYD SPR 1566/4885GUCY1A1 2940/4885GUCY1B1 2239/4885

“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.