SCHEMBL29550893

SCHEMBL29550893

CC([18F])COc1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AGXT P21549 2/20 0.53
KDM1A O60341 2/20 0.52
MAPK1 P28482 2/20 0.52
KDM4E B2RXH2 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
RAB9A P51151 5/20 0.51
NPC1 O15118 2/20 0.51
ALOX5 P09917 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP2A6 P11509 1/20 0.48
PTPN7 P35236 1/20 0.47
RECQL P46063 1/20 0.46
PPARG P37231 1/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL22849632 1.00 AGXT (0.53) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL29519635 0.85 AGXT (0.57) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL114254 0.85 AGXT (0.57) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL14764488 0.84 CYP2A6 (0.46) KDM1ATDP1RAB9ANPC1CYP1A2
SCHEMBL14764486 0.82 KDM1A (0.40) AGXTKDM1AMAPK1RAB9ANPC1
SCHEMBL29670114 0.81 LMNA (0.63) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL1435391 0.81 AGXT (0.58) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL7973999 0.81 LMNA (0.63) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL11831663 0.81 AGXT (0.58) AGXTKDM1AMAPK1KDM4ETDP1
SCHEMBL22838174 0.80 CYP1A2 (0.52) AGXTKDM1AMAPK1KDM4ETDP1

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-11306091-B2 Process for producing fluorinated compounds using alcohol solvent having unsaturated hydrocarbon FUTURECHEM CO., LTD (KR) 2022-04-19 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-11306091-B2 Process for producing fluorinated compounds using alcohol solvent having unsaturated hydrocarbon FASN, CYP2F1, FDFT1 AGXT 2684/4885KDM1A 2250/4885MAPK1 1383/4885

“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.