SCHEMBL5490221

SCHEMBL5490221

COC(=O)c1ccc(C)c(-c2ccc3c(Br)cncc3c2)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.50
KIT P10721 8/20 0.50
KDR P35968 7/20 0.44
LCK P06239 6/20 0.44
CSF1R P07333 1/20 0.44
CYP11B1 P15538 2/20 0.44
CYP11B2 P19099 2/20 0.44
CYP19A1 P11511 1/20 0.44
MAPK9 P45984 5/20 0.43
MAPK10 P53779 2/20 0.42
SLC2A1 P11166 1/20 0.41
ABL1 P00519 3/20 0.41
IL2 P60568 1/20 0.40
LYN P07948 1/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CYP2A6 P11509 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL5490650 0.86 AR (0.49) MAPK14KITKDRLCKCSF1R
SCHEMBL30800251 0.85 LCK (0.50) LCKCYP11B1CYP11B2CYP19A1CSNK2A2
SCHEMBL22559482 0.85 LCK (0.50) LCKCYP11B1CYP11B2CYP19A1CSNK2A2
SCHEMBL2952639 0.79 MAPK14 (0.52) MAPK14KITKDRLCKCSF1R
SCHEMBL396172 0.78 MAPK14 (0.51) MAPK14KITKDRLCKCSF1R
SCHEMBL5491447 0.78 POLQ (0.47) MAPK14KITKDRLCKCSF1R
SCHEMBL5496458 0.77 MMP2 (0.45) MAPK14KITKDRLCKCSF1R
SCHEMBL18105398 0.77 CYP11B1 (0.47) LCKCYP11B1CYP11B2CYP19A1ATM
SCHEMBL30034484 0.77 CYP11B1 (0.47) LCKCYP11B1CYP11B2CYP19A1ATM
SCHEMBL1405982 0.76 MAPK14 (0.53) MAPK14KITKDRLCKCSF1R

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 MAPK14 301/4885KIT 325/4885KDR 1044/4885

“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.