SCHEMBL1804301

SCHEMBL1804301

Cc1noc(C)c1-c1ccc2c(c1)C(=O)NCC1CN(C(=O)O)CC21

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.42
BRD2 P25440 5/20 0.39
BRD3 Q15059 3/20 0.39
CREBBP Q92793 2/20 0.39
ERN1 O75460 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
SCHEMBL1804297 1.00 BRD4 (0.42) BRD4BRD2BRD3CREBBPERN1
SCHEMBL1804300 1.00 BRD4 (0.42) BRD4BRD2BRD3CREBBPERN1
SCHEMBL1803418 0.88 GPR119 (0.47) BRD4BRD2BRD3
SCHEMBL2598837 0.88 GPR119 (0.47) BRD4BRD2BRD3
SCHEMBL1803415 0.88 GPR119 (0.47) BRD4BRD2BRD3
SCHEMBL2599154 0.82 RORC (0.37)
SCHEMBL2597945 0.81 BRD4 (0.47) BRD4BRD2BRD3CREBBPERN1
SCHEMBL1803411 0.81 BRD4 (0.47) BRD4BRD2BRD3CREBBPERN1
SCHEMBL1803409 0.81 BRD4 (0.47) BRD4BRD2BRD3CREBBPERN1
SCHEMBL1803413 0.81 BRD4 (0.47) BRD4BRD2BRD3CREBBPERN1

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-2571353-B1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF ABBVIE INC (US) 2017-08-09 EP disclosed
US-8846951-B2 Modulators of 5-HT receptors and methods of use thereof ABBVIE INC. (US) 2014-09-30 US disclosed
US-20110118231-A1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2011-05-19 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-20110118231-A1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF HTR3A, HTR5A, HTR3C BRD4 2085/4885BRD2 1985/4885BRD3 1631/4885

“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.