SCHEMBL5557798

SCHEMBL5557798

c1ccc(CN2CCN(Cc3ccccc3)C(CCc3cccnc3)C2)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
SIGMAR1 Q99720 2/20 0.54
TP53 P04637 1/20 0.53
MDM2 Q00987 1/20 0.53
LMNA P02545 2/20 0.52
ALDH1A1 P00352 1/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL5557786 1.00 KMT2A (0.55) KMT2ASIGMAR1TP53MDM2LMNA
SCHEMBL5556913 0.87 SIGMAR1 (0.60) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5556907 0.87 SIGMAR1 (0.60) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5557549 0.87 SIGMAR1 (0.68) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5557553 0.87 SIGMAR1 (0.68) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5558029 0.81 SIGMAR1 (0.61) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5558033 0.81 SIGMAR1 (0.61) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5564360 0.80 ALDH1A1 (0.62) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5558858 0.80 ALDH1A1 (0.62) KMT2ASIGMAR1LMNAALDH1A1MEN1
SCHEMBL5557480 0.80 DRD4 (0.60) KMT2ASIGMAR1LMNAALDH1A1MEN1

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
EP-1492794-B1 PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS LILLY CO ELI (US) 2007-12-12 EP disclosed
US-7214673-B2 For therapy of psychosis and bipolar disorder ELI LILLY AND COMPANY (US) 2007-05-08 US disclosed
US-20050203296-A1 For therapy of psychosis and bipolar disorder ELI LILLY AND COMPANY 2005-09-15 US 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-20050203296-A1 For therapy of psychosis and bipolar disorder DRD4, AFF4, DRD2 KMT2A 3291/4885SIGMAR1 61/4885TP53 3559/4885

“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.