SCHEMBL2994350

SCHEMBL2994350

CC1CC(C)(C)NC(C)(C)C1.[LiH]

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.37
ALPL P05186 1/20 0.35
LMNA P02545 3/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
RAD52 P43351 1/20 0.31
GFER P55789 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GAA P10253 2/20 0.31
MAPK1 P28482 1/20 0.31
KDM1A O60341 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL327787 0.97 RECQL (0.38) RECQLALPLLMNAALDH1A1MEN1
SCHEMBL9813654 0.86 RECQL (0.38) RECQLALPLLMNAALDH1A1MEN1
SCHEMBL10679200 0.86 RECQL (0.38) RECQLALPLLMNAALDH1A1MEN1
Acetic Acid SCHEMBL9813575 0.82 GAA (0.41) RECQLALDH1A1ALOX15KMT2AL3MBTL1
Phosphoric Acid SCHEMBL9813679 0.82 POLB (0.36) RECQLMEN1PKMKMT2AL3MBTL1
Phosphoric Acid SCHEMBL10680366 0.82 POLB (0.36) RECQLMEN1PKMKMT2AL3MBTL1
SCHEMBL18900996 0.80 RECQL (0.31) RECQL
SCHEMBL19143130 0.78 RECQL (0.36) RECQLALPLPKMKDM1AKDM4E
Cyclohexane SCHEMBL9813599 0.77 GAA (0.38) RECQLLMNAALDH1A1ALOX15KMT2A
Methyl Carbamate SCHEMBL9813667 0.75 ATM (0.39) RECQLALDH1A1MEN1PKMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101605800-B Lithium exchange reaction method LONZA AG 2013-01-09 CN disclosed
US-8198487-B2 Method for lithium exchange reactions LONZA AG (CH) 2012-06-12 US disclosed
EP-2109616-B1 METHOD FOR LITHIUM EXCHANGE REACTIONS LONZA AG (CH) 2010-08-25 EP disclosed
US-20100113839-A1 METHOD FOR LITHIUM EXCHANGE REACTIONS LONZA AG (CH) 2010-05-06 US disclosed
EP-1956023-A1 Method for lithium exchange reactions LONZA AG (CH) 2008-08-13 EP 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-20100113839-A1 METHOD FOR LITHIUM EXCHANGE REACTIONS SLC6A5, SLC6A9, SLC6A6 RECQL 2021/4885ALPL 2561/4885LMNA 1170/4885

“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.