SCHEMBL6153890

SCHEMBL6153890

CC(C)(C)c1ccc(OCC([NH])=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.71
MAOB P27338 1/20 0.55
AOC3 Q16853 1/20 0.55
MEN1 O00255 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
NR4A2 P43354 1/20 0.51
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
POLB P06746 2/20 0.51
CYP2C19 P33261 2/20 0.51
EPHX2 P34913 1/20 0.51
NR1H4 Q96RI1 1/20 0.51
GAA P10253 1/20 0.51
TSHR P16473 1/20 0.51
HCAR2 Q8TDS4 1/20 0.50
MAPK1 P28482 3/20 0.49
LMNA P02545 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49

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
SCHEMBL1283871 0.83 SMN1; SMN2 (1.00) SMN1; SMN2MEN1RAB9AKMT2ANR4A2
SCHEMBL8219820 0.83 SMN1; SMN2 (0.73) SMN1; SMN2MAOBAOC3MEN1RAB9A
SCHEMBL9219214 0.83 SMN1; SMN2 (0.59) SMN1; SMN2MEN1KMT2ACYP3A4HIF1A
SCHEMBL628857 0.81 SMN1; SMN2 (0.71) SMN1; SMN2MAOBAOC3MEN1RAB9A
SCHEMBL733369 0.81 SMN1; SMN2 (0.71) SMN1; SMN2MAOBAOC3MEN1RAB9A
SCHEMBL6153892 0.81 SMN1; SMN2 (0.71) SMN1; SMN2MAOBAOC3MEN1RAB9A
Hydrochloric Acid SCHEMBL4640626 0.81 SMN1; SMN2 (0.96) SMN1; SMN2MEN1RAB9AKMT2ANR4A2
SCHEMBL12622683 0.81 SMN1; SMN2 (0.71) SMN1; SMN2MAOBAOC3MEN1RAB9A
Ammonia Solution, Strong SCHEMBL28429402 0.81 SMN1; SMN2 (0.96) SMN1; SMN2MEN1RAB9AKMT2ANR4A2
SCHEMBL11220885 0.81 SMN1; SMN2 (0.47) SMN1; SMN2MAOBAOC3LMNAALOX15

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
WO-1998000434-A1 MODIFIED OLIGONUCLEOTIDES NOVARTIS AG (CH) 1998-01-08 WO claimed
US-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 US disclosed
WO-1998000434-A1 MODIFIED OLIGONUCLEOTIDES NOVARTIS AG (CH) 1998-01-08 WO disclosed
US-5294530-A amine developers emulsion layer containing a yellow or cyan coupler and a phenolic derivative FUJI PHOTO FILM CO., LTD. (JP) 1994-03-15 US disclosed
US-5104782-A Silver halide color photographic material containing a pyrazoloazole based coupler and having excellent color reproduction characteristics and which provides images having excellent light fastness FUJI PHOTO FILM CO., LTD. (JP) 1992-04-14 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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP SMN1; SMN2 2211/4885MAOB 3660/4885AOC3 2700/4885

“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.