SCHEMBL5500166

SCHEMBL5500166

Cc1c(B2OC(C)(C)C(C)(C)O2)cccc1C(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 16/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
P2RX1 P51575 1/20 0.54
PTGS1 P23219 1/20 0.53
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL25423049 0.84 RXFP1 (0.53) RXFP1SMN1; SMN2P2RX1PTGS1LMNA
SCHEMBL4016155 0.82 RAF1 (0.58) MAPT
SCHEMBL25421516 0.80 RXFP1 (0.52) RXFP1SMN1; SMN2P2RX1PTGS1LMNA
SCHEMBL29550365 0.79 RXFP1 (0.57) RXFP1SMN1; SMN2P2RX1PTGS1
SCHEMBL22915771 0.79 MEN1 (0.54) LMNAMAPT
SCHEMBL5488788 0.78 GAA (0.59) RXFP1P2RX1PTGS1LMNAMAPT
SCHEMBL2887561 0.77 BRAF (0.58) P2RX1PTGS1LMNAMAPT
SCHEMBL29536884 0.77 BRAF (0.58) P2RX1PTGS1LMNAMAPT
SCHEMBL59298 0.77 KMT2A (0.54) SMN1; SMN2LMNAMAPT
SCHEMBL11308212 0.77 PTGS1 (0.78) RXFP1SMN1; SMN2P2RX1PTGS1MAPT

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
EP-1836174-B2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2019-10-02 EP disclosed
EP-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP disclosed
EP-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 EP disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 US disclosed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2006-04-13 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-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use MAP3K1, MAP3K5, MAP3K2 RXFP1 3174/4885SMN1; SMN2 4067/4885P2RX1 478/4885

“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.