SCHEMBL1307334

SCHEMBL1307334

N#CCN1CCC(Oc2ccccn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.44
RET P07949 9/20 0.41
HRH3 Q9Y5N1 2/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
PDE10A Q9Y233 1/20 0.40
MAP2K1 Q02750 1/20 0.40
AVPR1A P37288 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
SCHEMBL6225535 0.82 HRH3 (0.49) EPHX2HRH3
SCHEMBL10819391 0.81 HRH3 (0.48) EPHX2RETHRH3PDE3BPDE3A
SCHEMBL5300149 0.79 ROCK1 (0.56) HRH3
SCHEMBL1306480 0.79 CARM1 (0.46) EPHX2PDE3BPDE3APDE10AAVPR1A
SCHEMBL1307520 0.78 HRH3 (0.58) HRH3
SCHEMBL13683393 0.78 EPHX2 (0.44) EPHX2RETHRH3PDE3BPDE3A
SCHEMBL29605026 0.77 AVPR1A (0.49) EPHX2AVPR1A
SCHEMBL20266971 0.77 AVPR1A (0.49) EPHX2AVPR1A
SCHEMBL2743227 0.76 PDE3B (0.50) EPHX2HRH3PDE3BPDE3APDE10A
SCHEMBL20412701 0.76 EPHX2 (0.49) EPHX2RETHRH3PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053457-B2 3-imidazolyl-indoles for the treatment of proliferative diseases NOVARTIS AG (CH) 2011-11-08 US disclosed
US-20100125064-A1 3-Imidazolyl-Indoles for the Treatment of Proliferative Diseases NOVARTIS AG (CH) 2010-05-20 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-20100125064-A1 3-Imidazolyl-Indoles for the Treatment of Proliferative Diseases MDM4, TP53, MDM2 EPHX2 4068/4885RET 886/4885HRH3 1388/4885

“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.