SCHEMBL20004338

SCHEMBL20004338

CC(C)c1ccc(N2CCC(F)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.50
MAPT P10636 6/20 0.48
ALDH1A1 P00352 4/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
MAPK1 P28482 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 3/20 0.48
GAA P10253 2/20 0.48
ALOX15 P16050 2/20 0.48
ALOX12 P18054 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
HPGD P15428 1/20 0.46
LMNA P02545 2/20 0.46
PANK3 Q9H999 3/20 0.44
HTR6 P50406 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL25016625 0.89 HRH3 (0.45) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL25017269 0.89 HRH3 (0.45) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL13929499 0.87 HTR6 (0.52) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL10147276 0.85 USP2 (0.54) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL15187981 0.85 HRH3 (0.50) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL20251137 0.83 MAPT (0.51) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL11977005 0.83 HRH3 (0.52) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL10118804 0.83 HRH3 (0.49) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL22854281 0.82 L3MBTL1 (0.43) HRH3MAPTALDH1A1L3MBTL1MAPK1
SCHEMBL15187982 0.82 HRH3 (0.46) HRH3MAPTALDH1A1L3MBTL1MAPK1

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-10906900-B2 Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-02-02 US disclosed
EP-3515912-B1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NAT RECH SCIENT (FR) 2020-10-14 EP disclosed
US-20190211011-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-07-11 US disclosed
WO-2018055316-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-03-29 WO 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-10906900-B2 Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases PSEN2, CLN6, MAPT HRH3 2124/4885MAPT 3/4885ALDH1A1 1121/4885
US-20190211011-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES PSEN2, SNCA, MAPT HRH3 2197/4885MAPT 3/4885ALDH1A1 1382/4885

“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.