SCHEMBL17035908

SCHEMBL17035908

FC(F)([18F])c1ccc(N2CCNCC2)nc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.60
KDM4E B2RXH2 3/20 0.56
LMNA P02545 2/20 0.56
ABL1 P00519 1/20 0.56
MAPT P10636 5/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.52
CYP3A4 P08684 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 1/20 0.51
HTT P42858 2/20 0.50
ADRB2 P07550 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NCF1 P14598 1/20 0.49
PLD1 Q13393 1/20 0.49

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
SCHEMBL30101389 1.00 ADRB1 (0.60) ADRB1KDM4ELMNAABL1MAPT
SCHEMBL231823 1.00 ADRB1 (0.60) ADRB1KDM4ELMNAABL1MAPT
Hydrochloric Acid SCHEMBL9530917 0.98 ADRB1 (0.59) ADRB1KDM4ELMNAABL1MAPT
Hydrochloric Acid SCHEMBL9394896 0.98 ADRB1 (0.59) ADRB1KDM4ELMNAABL1MAPT
SCHEMBL30567235 0.94 ADRB1 (0.55) ADRB1KDM4ELMNAABL1MAPT
SCHEMBL2155294 0.94 ADRB1 (0.55) ADRB1KDM4ELMNAABL1MAPT
Hydrochloric Acid SCHEMBL2120987 0.93 ADRB1 (0.54) ADRB1KDM4ELMNAABL1MAPT
SCHEMBL1742865 0.88 GPR119 (0.57) ADRB1KDM4ELMNAABL1ADRB2
SCHEMBL15316690 0.87 ADRB1 (0.50) ADRB1KDM4ELMNAABL1MAPT
SCHEMBL6809004 0.85 GAA (0.60) KDM4ELMNAABL1MAPTSMN1; SMN2

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-20150239796-A1 ONE POT SYNTHESIS OF 18F LABELEDTRIFLUOROMETHYLATED COMPOUNDS WITH DIFLUORO(IODO)METHANE UNIVERSITY OF OSLO (NO) 2015-08-27 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-20150239796-A1 ONE POT SYNTHESIS OF 18F LABELEDTRIFLUOROMETHYLATED COMPOUNDS WITH DIFLUORO(IODO)METHANE FLI1, AFF1, CYP2F1 ADRB1 2133/4885KDM4E 1321/4885LMNA 4820/4885

“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.