SCHEMBL1315538

SCHEMBL1315538

CN(CC1CCNCC1)C(=O)NC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.51
SIGMAR1 Q99720 2/20 0.43
CHRM5 P08912 1/20 0.43
CHRM3 P20309 1/20 0.43
PKM P14618 1/20 0.42
HPGD P15428 2/20 0.40
ADRA2A P08913 1/20 0.40
PDE4A P27815 1/20 0.40
ADRA1A P35348 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL27837835 0.79 ALOX15 (0.38) EPHX1EPHX2
SCHEMBL9008707 0.76 EPHX1 (0.52) EPHX1SIGMAR1CHRM5CHRM3EPHX2
SCHEMBL23169461 0.75 PKM (0.50) EPHX1PKMADRA2APDE4AADRA1A
SCHEMBL1313991 0.74 ALDH1A1 (0.39) EPHX1HPGDALDH1A1
SCHEMBL16118651 0.73 TSHR (0.42) EPHX1PKMHPGDKMT2ANPC1
SCHEMBL16118643 0.73 LMNA (0.53) EPHX1PKMKMT2ANPC1RAB9A
SCHEMBL249281 0.73 ALOX15 (0.41) EPHX1
SCHEMBL785991 0.73 USP30 (0.43)
SCHEMBL13369546 0.73 USP30 (0.42) EPHX1KDM4E
SCHEMBL16099597 0.72 ALDH1A1 (0.58) EPHX1PKMHPGDKMT2ASMN1; SMN2

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-20110275670-A1 New Compounds VII BIOVITRUM AB (SE) 2011-11-10 US claimed
EP-2321276-A1 NEW COMPOUNDS VII AstraZeneca AB (SE) 2011-05-18 EP claimed
WO-2009147219-A1 NEW COMPOUNDS VII BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO claimed
US-20110275670-A1 New Compounds VII BIOVITRUM AB (SE) 2011-11-10 US disclosed
EP-2321276-A1 NEW COMPOUNDS VII AstraZeneca AB (SE) 2011-05-18 EP disclosed
WO-2009147219-A1 NEW COMPOUNDS VII BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO disclosed
US-4370328-A Cardiac stimulant 1-(3- or 4-substituted piperidino)phthalazines PFIZER INC. (US) 1983-01-25 US disclosed
EP-0017411-B1 PHTHALAZINE CARDIAC STIMULANTS, PROCESSES FOR PREPARING THEM, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Pfizer Limited (GB) 1982-03-31 EP disclosed
EP-0017411-A1 Phthalazine cardiac stimulants, processes for preparing them, and pharmaceutical compositions containing them Pfizer Limited (GB) 1980-10-15 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-20110275670-A1 New Compounds VII GPR119, GLP1R, GIPR EPHX1 3339/4885SIGMAR1 1999/4885CHRM5 1855/4885

“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.