SCHEMBL19867589

SCHEMBL19867589

CC1CCN(c2cnc(B3OC(C)(C)C(C)(C)O3)cn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
AR P10275 1/20 0.37
TSHR P16473 3/20 0.33
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
PKM P14618 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
LMNA P02545 3/20 0.32
LCK P06239 1/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
OGA O60502 1/20 0.32
KCNH2 Q12809 2/20 0.32
GPR119 Q8TDV5 2/20 0.32
GAA P10253 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
SCHEMBL24894908 0.89 MAPT (0.32) MAPTHRH3KCNH2GPR119
SCHEMBL12731410 0.85 MAPT (0.36) MAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL29197189 0.84 LRRK2 (0.31)
SCHEMBL30141576 0.84 LRRK2 (0.31)
SCHEMBL25473799 0.84 LRRK2 (0.31)
SCHEMBL12731668 0.83 ALDH1A1 (0.40) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL31372447 0.83 ALDH1A1 (0.40) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL10137346 0.83 HRH4 (0.40) ALDH1A1HRH3ALOX15
SCHEMBL9946217 0.80 MAPT (0.51) MAPTARTSHRALDH1A1NPC1
SCHEMBL24894886 0.78 LRRK2 (0.34) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066447-B2 Aureobasidium derivatives and methods of synthesis AueroGen Biosciences, Inc. (US) 2021-07-20 US disclosed
US-20190292225-A1 AUREOBASIDIUM DERIVATIVES AND METHODS OF SYNTHESIS AUREOGEN BIOSCIENCES, INC. 2019-09-26 US disclosed
WO-2018031521-A1 AUREOBASIDIUM DERIVATIVES AND METHODS OF SYNTHESIS AUREOGEN BIOSCIENCES, INC. (US) 2018-02-15 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-20190292225-A1 AUREOBASIDIUM DERIVATIVES AND METHODS OF SYNTHESIS ERG28, FDPS, AAAS MAPT 2044/4885AR 1044/4885TSHR 4413/4885
US-11066447-B2 Aureobasidium derivatives and methods of synthesis ERG28, FDPS, AAAS MAPT 2044/4885AR 1044/4885TSHR 4413/4885

“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.