SCHEMBL315786

SCHEMBL315786

CC(C)(C)OC(=O)N1CCN(CCOC(=O)Oc2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
MAPT P10636 3/20 0.57
LMNA P02545 2/20 0.57
HRH2 P25021 1/20 0.54
HRH1 P35367 1/20 0.54
MGLL Q99685 2/20 0.48
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FAAH O00519 1/20 0.45
EPHX2 P34913 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
SCHEMBL16570456 0.87 HRH2 (0.64) ALDH1A1MAPTLMNAHRH2HRH1
SCHEMBL31548821 0.84 ALDH1A1 (0.54) ALDH1A1MAPTLMNA
SCHEMBL314573 0.84 ALDH1A1 (0.53) ALDH1A1MAPTHRH2HRH1KMT2A
Hydrochloric Acid SCHEMBL11350175 0.84 EPHX2 (0.50) ALDH1A1EPHX2
SCHEMBL392783 0.83 ALDH1A1 (0.72) ALDH1A1MAPTLMNAMGLLFAAH
SCHEMBL22609266 0.82 HRH2 (0.58) ALDH1A1MAPTLMNAHRH2HRH1
SCHEMBL313831 0.81 ALDH1A1 (0.55) ALDH1A1MAPTLMNA
SCHEMBL16088361 0.81 KDM4E (0.67) ALDH1A1MAPTHRH2HRH1KMT2A
SCHEMBL4573720 0.80 KCNJ1 (0.65) ALDH1A1MAPTLMNA
Hydrochloric Acid SCHEMBL16054922 0.80 KDM4E (0.66) ALDH1A1MAPTHRH2HRH1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025094035-A1 TOLL-LIKE RECEPTOR AGONISTS AND CONJUGATES THEREOF PFIZER INC. (US) 2025-05-08 WO disclosed
EP-2234992-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2012-02-22 EP disclosed
US-8093248-B2 Compounds useful for the treatment of conditions associated with weight gain ASTRAZENECA AB (PUBL) (SE) 2012-01-10 US disclosed
EP-2234992-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-10-06 EP disclosed
US-20090281087-A1 Compounds II BIOVITRUM AB (SE) 2009-11-12 US disclosed
US-20090203695-A1 Compounds IV BIOVITRUM AB (SE) 2009-08-13 US disclosed
WO-2009071668-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS BIOVITRUM AB (PUBL) (SE) 2009-06-11 WO 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-20090281087-A1 Compounds II GPR119, FABP4, LIPC ALDH1A1 2717/4885MAPT 4470/4885LMNA 754/4885
US-20090203695-A1 Compounds IV GPR119, FABP4, LIPC ALDH1A1 2629/4885MAPT 4595/4885LMNA 748/4885

“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.