SCHEMBL10248096

SCHEMBL10248096

CC(=O)CCCCN1CN(c2ccccc2)C2(CCN(CCCn3c(=O)[nH]c4ccccc43)CC2)C1=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 5/20 0.52
BDKRB2 P30411 1/20 0.49
LMNA P02545 1/20 0.48
P2RX7 Q99572 2/20 0.47

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
SCHEMBL16244928 0.93 HTR7 (0.54) HTR7LMNAP2RX7
SCHEMBL318717 0.92 HTR7 (0.55) HTR7LMNAP2RX7
SCHEMBL318844 0.91 HTR7 (0.50) HTR7LMNAP2RX7
SCHEMBL16244973 0.91 HTR7 (0.55) HTR7LMNAP2RX7
SCHEMBL318661 0.87 HTR7 (0.49) HTR7LMNAP2RX7
SCHEMBL318815 0.87 HTR7 (0.49) HTR7LMNAP2RX7
SCHEMBL18601779 0.85 HTR7 (0.59) HTR7LMNAP2RX7
SCHEMBL10248398 0.85 MEN1 (0.53) HTR7P2RX7
SCHEMBL10248378 0.84 P2RX7 (0.49) HTR7LMNAP2RX7
SCHEMBL11507592 0.84 HTR7 (0.62) HTR7LMNAP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 US disclosed
US-8691836-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2014-04-08 US disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 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 (2 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-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 HTR7 171/4885BDKRB2 31/4885LMNA 4596/4885
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 HTR7 171/4885BDKRB2 31/4885LMNA 4596/4885

“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.