SCHEMBL7385455

SCHEMBL7385455

CNCCC(=O)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.57
POLB P06746 2/20 0.53
TSHR P16473 2/20 0.53
LMNA P02545 1/20 0.53
ALDH1A1 P00352 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
RAB9A P51151 2/20 0.49
FKBP1A P62942 3/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
GAA P10253 2/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPC1 O15118 1/20 0.44
USP2 O75604 1/20 0.44

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
Trifluoroacetic Acid SCHEMBL9069511 0.89 GLA (0.48) GLAPOLBTSHRLMNAALDH1A1
SCHEMBL13853557 0.82 GLA (0.51) GLAPOLBTSHRLMNAALDH1A1
SCHEMBL18909475 0.82 ATM (0.52) POLBLMNAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL13188548 0.82 ATM (0.58) POLBLMNAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL13645749 0.81 GLA (0.54) GLAPOLBTSHRLMNAALDH1A1
SCHEMBL14079952 0.81 TSHR (0.54) GLAPOLBTSHRLMNAALDH1A1
Dimethylamine SCHEMBL27882636 0.81 TSHR (0.57) GLAPOLBTSHRLMNAALDH1A1
SCHEMBL25676935 0.80 LMNA (0.53) GLAPOLBTSHRLMNAALDH1A1
SCHEMBL1484933 0.80 L3MBTL1 (0.53) GLAPOLBTSHRLMNAALDH1A1
SCHEMBL20693526 0.80 ATM (0.56) ALDH1A1L3MBTL1HTTSMN1; SMN2GAA

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-20240208934-A1 ULK1/2 INHIBITORS AND THEIR USE THEREOF LIFEARC (GB) 2024-06-27 US disclosed
US-20240208934-A1 ULK1/2 INHIBITORS AND THEIR USE THEREOF LIFEARC (GB) 2024-06-27 US disclosed
WO-2010100144-A1 FUSED BICYCLIC COMPOUNDS AS INHIBITORS FOR PI3 KINASE MERCK SERONO S.A. (CH) 2010-09-10 WO disclosed
US-20090221458-A1 SUCCINIC ACID SEMI-AMIDES AS ANTI-CORROSIVE AGENTS CAMENZIND HUGO 2009-09-03 US disclosed
US-5693619-A ENZYME INHIBITORS; ADMINISTERED TO TREAT CONGESTIVE HEART FAILURE AND HYPERTENSION BOEHRINGER INGELHEIM (CANADA), LTD. (CA) 1997-12-02 US disclosed
EP-0589445-B1 Renin Inhibiting N-(2-Amino-2-oxoethyl)Butanediamide Derivatives BIO MEGA BOEHRINGER INGELHEIM (CA) 1997-01-15 EP disclosed
US-5541163-A HYPOTENSIVE AGENTS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1996-07-30 US disclosed
WO-1994007846-A1 RENIN INHIBITING N-(2-AMINO-2-OXOETHYL)BUTANEDIAMIDE DERIVATIVES BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-04-14 WO disclosed
EP-0589445-A1 Renin Inhibiting N-(2-Amino-2-oxoethyl)Butanediamide Derivatives BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-03-30 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-20240208934-A1 ULK1/2 INHIBITORS AND THEIR USE THEREOF ULK1, ULK2, ULK3 GLA 3355/4885POLB 1546/4885TSHR 3950/4885

“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.