SCHEMBL9824760

SCHEMBL9824760

C=C(c1ccccc1)C(N)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.44
F2 P00734 1/20 0.44
LMNA P02545 2/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2C P18825 1/20 0.40
HIF1A Q16665 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL12435149 1.00 DPP4 (0.44) DPP4F2LMNAADRA2AADRA2C
SCHEMBL12729962 0.78 DPP4 (0.50) DPP4F2LMNAADRA2AADRA2C
SCHEMBL8643386 0.78 DPP4 (0.50) DPP4F2LMNAADRA2AADRA2C
SCHEMBL16062547 0.76 L3MBTL1 (0.54) LMNATDP1L3MBTL1KDM4EALDH1A1
SCHEMBL3262994 0.76 DPP4 (0.48) DPP4F2LMNAADRA2AADRA2C
SCHEMBL4631540 0.74 LMNA (0.56) LMNAADRA2CTDP1L3MBTL1KDM4E
SCHEMBL16838683 0.74 ADRA2A (0.46) DPP4F2LMNAADRA2AADRA2C
SCHEMBL4662816 0.74 LMNA (0.47) F2LMNAADRA2AADRA2CHIF1A
SCHEMBL5975716 0.74 ADRA2A (0.46) DPP4F2LMNAADRA2AADRA2C
SCHEMBL8201163 0.74 ADRA2A (0.46) DPP4F2LMNAADRA2AADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0132764-A2 Derivatives of dihydrodibenzocycloheptylidene-ethylamine SOCIEDAD ESPANOLA DE ESPECIALIDADES FARMACO-TERAPEUTICAS, S.A. (ES) 1985-02-13 EP claimed
JP-52142051-A None JP disclosed
US-8268894-B2 Compositions and methods for the treatment of infectious diseases THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-09-18 US disclosed
US-20110118307-A1 Compositions and methods for the treatment of infectious diseases GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2011-05-19 US disclosed
US-7456222-B2 Anti tubercular drug: compositions and methods SEQUELLA, INC. (US) 2008-11-25 US disclosed
EP-0250254-B1 CIS & TRANS STILBENES AND THEIR COMPOSITION FOR THE TREATMENT OF HYPERTENSION McNeilab, Inc. (US) 1991-06-19 EP disclosed
EP-0250254-A1 Cis & trans stilbenes and their composition for the treatment of hypertension McNeilab, Inc. (US) 1987-12-23 EP disclosed
EP-0132764-A2 Derivatives of dihydrodibenzocycloheptylidene-ethylamine SOCIEDAD ESPANOLA DE ESPECIALIDADES FARMACO-TERAPEUTICAS, S.A. (ES) 1985-02-13 EP disclosed
EP-0132764-A2 Derivatives of dihydrodibenzocycloheptylidene-ethylamine SOCIEDAD ESPANOLA DE ESPECIALIDADES FARMACO-TERAPEUTICAS, S.A. (ES) 1985-02-13 EP disclosed
JP-S52142051-A 1,2-DIPHENYLALKYLAMINE DERIVATIVES AND THEIR PREPARATION RES INST FOR PROD DEV 1977-11-26 JP 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-20110118307-A1 Compositions and methods for the treatment of infectious diseases TERT, C5, ELANE DPP4 2300/4885F2 1669/4885LMNA 940/4885

“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.