SCHEMBL3493014

SCHEMBL3493014

c1ccc(COCCC2CN(Cc3ccccc3)CCN2Cc2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
SIGMAR1 Q99720 6/20 0.54
POLB P06746 2/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.50

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
SCHEMBL7573297 0.86 SIGMAR1 (0.56) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL15341688 0.86 TSHR (0.44) SIGMAR1
SCHEMBL4844085 0.85 SIGMAR1 (0.62) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL4844073 0.85 SIGMAR1 (0.62) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL27929970 0.82 LMNA (0.53) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL5557549 0.81 SIGMAR1 (0.68) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL5557553 0.81 SIGMAR1 (0.68) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL3494735 0.80 SIGMAR1 (0.80) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL4836976 0.80 SIGMAR1 (0.80) LMNAMEN1KMT2ASIGMAR1POLB
SCHEMBL31421250 0.80 LMNA (0.60) LMNAMEN1KMT2ASIGMAR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 US disclosed
EP-1984355-A2 CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION Takeda Pharmaceutical Company Limited (JP) 2008-10-29 EP disclosed
WO-2007094513-A2 CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-08-23 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 (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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension REN, AGTR1, AGTR2 LMNA 201/4885MEN1 750/4885KMT2A 952/4885

“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.