SCHEMBL4391046

SCHEMBL4391046

CC1CC(C)(C)CN1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
GAA P10253 1/20 0.44
GRM6 O15303 1/20 0.42
ACHE P22303 1/20 0.42
SIGMAR1 Q99720 5/20 0.42
TMEM97 Q5BJF2 1/20 0.42
OPRM1 P35372 1/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL21057421 0.83 MAPT (0.45) MAPTGAAGRM6ACHESIGMAR1
SCHEMBL27635261 0.81 MAPT (0.43) MAPTGAAGRM6ACHESIGMAR1
SCHEMBL3604990 0.81 MAPT (0.47) MAPTGAAGRM6TMEM97LMNA
SCHEMBL4401474 0.80 MAPT (0.45) MAPTGRM6ACHESIGMAR1TMEM97
SCHEMBL8142711 0.79 GBA1 (0.46) MAPTGAAGRM6SIGMAR1MEN1
SCHEMBL28180619 0.79 GAA (0.44) MAPTGAAGRM6SIGMAR1TMEM97
SCHEMBL2205566 0.78 MAPT (0.43) MAPTGRM6TMEM97TSHRKMT2A
SCHEMBL4395795 0.77 MAPT (0.42) MAPTGRM6SIGMAR1TMEM97OPRM1
SCHEMBL22525231 0.76 MAPT (0.46) MAPTGRM6ACHELMNAMEN1
SCHEMBL21563539 0.76 MAPT (0.46) MAPTGRM6ACHELMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120190854-A1 Hydroamination of Alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-07-26 US disclosed
US-20120190854-A1 Hydroamination of Alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-07-26 US disclosed
US-20120190854-A1 Hydroamination of Alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-07-26 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 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 (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-20090156824-A1 Hydroamination of Alkenes HRH3, HRH4, H1-3 MAPT 3666/4885GAA 4511/4885GRM6 1550/4885
US-20120190854-A1 Hydroamination of Alkenes HRH3, HRH4, H1-3 MAPT 3666/4885GAA 4511/4885GRM6 1550/4885

“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.