SCHEMBL29660442

SCHEMBL29660442

COc1nc(-c2nc(C)cs2)nc(F)c1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
PTGS2 P35354 1/20 0.32
MAPT P10636 3/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PDE10A Q9Y233 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
SMPD1 P17405 1/20 0.31
CYP2E1 P05181 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL27199224 1.00 ADORA2A (0.32) ADORA2AADORA1PTGS2MAPTNPC1
Hydrochloric Acid SCHEMBL23302365 0.88 PLAU (0.34)
SCHEMBL27199222 0.86 IDH1 (0.38) TGFBR1MEN1KMT2A
SCHEMBL29660508 0.86 IDH1 (0.38) TGFBR1MEN1KMT2A
SCHEMBL29660483 0.78 SYK (0.38) ADORA2AADORA1NPC1RAB9AKMT2A
SCHEMBL23334273 0.78 SYK (0.38) ADORA2AADORA1NPC1RAB9AKMT2A
SCHEMBL29660533 0.78 RECQL (0.38) PTGS2MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL27199215 0.78 RECQL (0.38) PTGS2MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL22042759 0.72 MAPT (0.49) MAPTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL30151244 0.72 MAPT (0.49) MAPTNPC1RAB9ASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435076-B2 Fluorine-containing pyrimidine compound and method for producing same UNIMATEC CO., LTD. (JP) 2025-10-07 US disclosed
CN-114502551-B Fluorine-containing pyrimidine compound and preparation method thereof 优迈特株式会社 2023-08-22 CN disclosed
EP-4053123-A1 FLUORINATED PYRIMIDINE COMPOUND AND METHOD FOR MANUFACTURING SAME Unimatec Co., Ltd. (JP) 2022-09-07 EP disclosed
CN-114502551-A Fluorine-containing pyrimidine compound and preparation method thereof 优迈特株式会社 2022-05-13 CN 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-12435076-B2 Fluorine-containing pyrimidine compound and method for producing same CNOT1, HAO1, NUDT1 ADORA2A 538/4885ADORA1 108/4885PTGS2 4000/4885

“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.