SCHEMBL1622835

SCHEMBL1622835

CN(C)C=C1CCN(C(=O)O)CCC1=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMARCA4 P51532 1/20 0.34
PBRM1 Q86U86 1/20 0.32

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
SCHEMBL1622831 1.00 SMARCA4 (0.34) SMARCA4PBRM1
SCHEMBL17893716 0.88 SMARCA4 (0.31) SMARCA4
SCHEMBL21990761 0.88 SMARCA4 (0.33) SMARCA4PBRM1
SCHEMBL28152878 0.88 SMARCA4 (0.33) SMARCA4PBRM1
SCHEMBL710471 0.88 SMARCA4 (0.31) SMARCA4
SCHEMBL710472 0.88 SMARCA4 (0.31) SMARCA4
SCHEMBL4052256 0.80 CYP2D6 (0.31)
SCHEMBL4052259 0.80 CYP2D6 (0.31)
SCHEMBL24417745 0.79 USP2 (0.43)
SCHEMBL1621681 0.79 USP2 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928099-B2 Pyrimido [4,5-D] azepine derivatives as 5-HT2c agonists PFIZER INC (US) 2011-04-19 US disclosed
US-20100113422-A1 Pyrimido [4,5-D] Azepine Derivatives As 5-HT2C Agonists ANDREWS MARK 2010-05-06 US disclosed
CN-101652367-A Pyrimido [4, 5-D ] azepine derivatives as 5-HT 2C agonists PFIZER LTD GB 2010-02-17 CN disclosed
EP-2139896-A1 PYRIMIDO [4, 5-D]AZEPINE DERIVATIVES AS 5-HT2C AGONISTS Pfizer Limited (GB) 2010-01-06 EP disclosed
WO-2008117169-A1 PYRIMIDO [4, 5-D] AZEPINE DERIVATIVES AS 5-HT2C AGONISTS PFIZER LIMITED (GB) 2008-10-02 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-20100113422-A1 Pyrimido [4,5-D] Azepine Derivatives As 5-HT2C Agonists HTR2C, HTR2A, HTR5A SMARCA4 3402/4885PBRM1 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.