SCHEMBL392980

SCHEMBL392980

CC(C)(C)OC(=O)N1CCN(C(=O)N2CCOCC2)CC1

nearest known ligand 0.83

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.83
USP2 O75604 1/20 0.83
RECQL P46063 2/20 0.65
MEN1 O00255 1/20 0.55
TP53 P04637 1/20 0.55
KMT2A Q03164 1/20 0.55
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.49
POLB P06746 1/20 0.47
AKR1C3 P42330 3/20 0.46

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
SCHEMBL3086430 0.95 USP2 (0.75) SMN1; SMN2USP2RECQLMEN1TP53
SCHEMBL344191 0.93 SMN1; SMN2 (0.96) SMN1; SMN2USP2RECQLTP53TSHR
SCHEMBL20448044 0.91 SMN1; SMN2 (1.00) SMN1; SMN2USP2RECQLTP53TSHR
SCHEMBL27388627 0.89 USP2 (0.62) SMN1; SMN2USP2RECQLMEN1KMT2A
Acetic Acid SCHEMBL29118271 0.87 SMN1; SMN2 (0.86) SMN1; SMN2USP2RECQLTSHRPOLB
SCHEMBL2920417 0.86 SMN1; SMN2 (0.83) SMN1; SMN2USP2RECQLMEN1TP53
SCHEMBL18084793 0.84 SMN1; SMN2 (0.80) SMN1; SMN2USP2RECQLMEN1TP53
SCHEMBL28204425 0.84 SMN1; SMN2 (0.80) SMN1; SMN2USP2RECQLTSHRPOLB
SCHEMBL26129549 0.83 HPGD (0.60) SMN1; SMN2USP2RECQLMEN1KMT2A
Formic Acid Methyl Ester SCHEMBL29022264 0.83 SMN1; SMN2 (0.77) SMN1; SMN2USP2RECQLTSHRPOLB

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778299-B Piperazine ureido derivatives, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2023-07-14 CN disclosed
CN-112778299-A Piperazine ureido derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2021-05-11 CN disclosed
EP-1812445-B1 PHARMACEUTICAL COMPOUNDS PIRAMED LTD (GB) 2015-12-30 EP disclosed
EP-1812444-B1 PHARMACEUTICAL COMPOUNDS PIRAMED LTD (GB) 2015-08-26 EP disclosed
US-8946217-B2 Pharmaceutical compounds F. HOFFMANN-LA ROCHE AG (CH) 2015-02-03 US disclosed
US-20140294946-A1 PHARMACEUTICAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-10-02 US disclosed
US-20130317017-A1 PHARMACEUTICAL COMPOUNDS F. HOFFMAN-LA ROCHE AG (CH) 2013-11-28 US disclosed
US-20120258966-A1 PHARMACEUTICAL COMPOUNDS F. HOFFMAN-LA ROCHE AG (CH) 2012-10-11 US disclosed
US-8153629-B2 Pharmaceutical compounds F. HOFFMANN-LA ROCHE AG (CH) 2012-04-10 US disclosed
US-8101607-B2 Pharmaceutical compounds F. HOFFMAN-LA ROCHE AG (CH) 2012-01-24 US disclosed
US-7776856-B2 Pharmaceutical compounds F. HOFFMAN-LA ROCHE AG (CH) 2010-08-17 US disclosed
US-7750002-B2 Pharmaceutical compounds PIRAMED LIMITED (GB) 2010-07-06 US disclosed
US-20090131429-A1 Pharmaceutical compounds F. HOFFMANN-LA ROCHE AG (CH) 2009-05-21 US disclosed
US-20080207611-A1 Pharmaceutical compounds PLRAMED LIMITED (GB) 2008-08-28 US disclosed
EP-1812445-A1 PHARMACEUTICAL COMPOUNDS Piramed Limited (GB) 2007-08-01 EP disclosed
EP-1812444-A1 PHARMACEUTICAL COMPOUNDS Piramed Limited (GB) 2007-08-01 EP disclosed
WO-2006046031-A1 PHARMACEUTICAL COMPOUNDS PIRAMED LIMITED (GB) 2006-05-04 WO disclosed
WO-2006046035-A1 PHARMACEUTICAL COMPOUNDS PIRAMED LIMITED (GB) 2006-05-04 WO disclosed
US-5561140-A IMMUNOSUPPRESSANTS; SIDE EFFECT REDUCTION ABBOTT LABORATORIES (US) 1996-10-01 US disclosed
US-5530119-A IMMUNOSUPPRESSANTS ABBOTT LABORATORIES (US) 1996-06-25 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 (5 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-20140294946-A1 PHARMACEUTICAL COMPOUNDS PIK3CA, JAK2, PIK3R1 SMN1; SMN2 1242/4885USP2 4409/4885RECQL 311/4885
US-20090131429-A1 Pharmaceutical compounds PIK3CA, PIK3C2B, PIK3CD SMN1; SMN2 2169/4885USP2 4272/4885RECQL 547/4885
US-20080207611-A1 Pharmaceutical compounds PIK3CA, JAK2, PIK3R1 SMN1; SMN2 1238/4885USP2 4410/4885RECQL 316/4885
US-20120258966-A1 PHARMACEUTICAL COMPOUNDS PIK3CA, JAK2, PIK3R1 SMN1; SMN2 1242/4885USP2 4409/4885RECQL 311/4885
US-20130317017-A1 PHARMACEUTICAL COMPOUNDS PIK3CA, JAK2, PIK3R1 SMN1; SMN2 1242/4885USP2 4409/4885RECQL 311/4885

“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.