SCHEMBL20133771

SCHEMBL20133771

C=CC1CCCN(c2cccc(C)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.49
NOTUM Q6P988 1/20 0.47
KCNH2 Q12809 2/20 0.44
GPR119 Q8TDV5 1/20 0.43
MAPT P10636 5/20 0.42
ALDH1A1 P00352 3/20 0.42
RAB9A P51151 2/20 0.42
KMT2A Q03164 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
DHFR P00374 1/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
HTR7 P34969 1/20 0.38
NPY5R Q15761 1/20 0.38
TP53 P04637 1/20 0.38
CYP2C19 P33261 1/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL20133603 0.79 ADRB1 (0.54) ADRB1NOTUMKCNH2GPR119MAPT
SCHEMBL23803729 0.79 NOTUM (0.55) ADRB1NOTUMKCNH2GPR119MAPT
SCHEMBL8264176 0.78 ADRB1 (0.69) ADRB1NOTUMKCNH2MAPTALDH1A1
SCHEMBL12991 0.78 ADRB1 (0.69) ADRB1NOTUMKCNH2MAPTALDH1A1
SCHEMBL17281442 0.76 ADRB1 (0.67) ADRB1NOTUMKCNH2MAPTALDH1A1
SCHEMBL3307690 0.76 ADRB1 (0.67) ADRB1NOTUMKCNH2MAPTALDH1A1
Hydrochloric Acid SCHEMBL27827352 0.76 ADRB1 (0.67) ADRB1NOTUMKCNH2MAPTALDH1A1
SCHEMBL14528639 0.75 L3MBTL3 (0.59) ADRB1NOTUMKCNH2GPR119ALDH1A1
SCHEMBL25996264 0.75 NOTUM (0.54) NOTUMKCNH2ALDH1A1TSHR
SCHEMBL21180882 0.75 ADRB1 (0.48) ADRB1GPR119MAPTALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2018-05-10 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-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR ADRB1 4438/4885NOTUM 1789/4885KCNH2 3487/4885

“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.