SCHEMBL1616175

SCHEMBL1616175

Cc1ccc(C2CCCC(Br)C2=O)cc1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
NOTUM Q6P988 1/20 0.33
ADCY8 P40145 1/20 0.33
ADCY1 Q08828 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.32
POLQ O75417 1/20 0.31
AR P10275 5/20 0.31
PDE2A O00408 1/20 0.30

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
SCHEMBL1616272 0.89 PDE2A (0.33) ARPDE2A
SCHEMBL1617282 0.84 ABCC9 (0.38) PDE3BPDE3ANOTUM
SCHEMBL1616148 0.82 SIRT2 (0.40)
SCHEMBL1138761 0.78 AR (0.36) PDE3BPDE3ANOTUMADCY8ADCY1
SCHEMBL195564 0.77 HTR2C (0.40) PDE2A
SCHEMBL1617263 0.75 HTR2C (0.46)
SCHEMBL12762087 0.75 HTR2A (0.44) PDE3BPDE3AADCY8ADCY1POLQ
SCHEMBL22246620 0.71 HTR2A (0.44) ADCY8ADCY1POLQAR
SCHEMBL3434595 0.71 POLQ (0.47) PDE3BPDE3ANOTUMADCY8ADCY1
SCHEMBL18162314 0.71 POLQ (0.47) PDE3BPDE3ANOTUMADCY8ADCY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012030952-A3 REDUCING RIPPLE CURRENT IN A SWITCHED-MODE POWER CONVERTER EMPLOYING A BRIDGE TOPOLOGY TEXAS INSTRUMENTS INCORPORATED (US) 2012-05-10 WO disclosed
EP-2231629-B1 MODULATORS FOR AMYLOID BETA HOFFMANN LA ROCHE (CH) 2011-11-30 EP disclosed
US-7923450-B2 Modulators for amyloid beta HOFFMANN-LA ROCHE INC. (US) 2011-04-12 US disclosed
EP-2231629-A1 MODULATORS FOR AMYLOID BETA F. Hoffmann-La Roche AG (CH) 2010-09-29 EP disclosed
WO-2009087127-A1 MODULATORS FOR AMYLOID BETA F. HOFFMANN-LA ROCHE AG (CH) 2009-07-16 WO disclosed
US-20090181965-A1 MODULATORS FOR AMYLOID BETA F. HOFFMANN-LA ROCHE AG (CH) 2009-07-16 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-20090181965-A1 MODULATORS FOR AMYLOID BETA APP, PSEN1, BACE1 PDE3B 1350/4885PDE3A 614/4885NOTUM 4034/4885

“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.