SCHEMBL17857008

SCHEMBL17857008

C=CC(=O)N1CCC[C@H]1C(=O)Nc1ccc(OC)c(Nc2cc(N(C)C(=O)NCc3ccccc3)ncn2)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
APP P05067 3/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
FGFR4 P22455 5/20 0.44
FGFR2 P21802 3/20 0.44
FGFR3 P22607 3/20 0.44
BTK Q06187 1/20 0.44
TP53 P04637 1/20 0.43
FGFR1 P11362 5/20 0.42
USP2 O75604 1/20 0.42

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
SCHEMBL17856995 1.00 ALDH1A1 (0.54) ALDH1A1APPMEN1KMT2AFGFR4
SCHEMBL17856993 0.84 FGFR4 (0.58) FGFR4FGFR2FGFR3BTKFGFR1
SCHEMBL21081491 0.81 FGFR4 (0.49) MEN1KMT2AFGFR4FGFR2FGFR3
SCHEMBL17837344 0.81 EGFR (0.53) ALDH1A1APPMEN1KMT2AFGFR2
SCHEMBL17837345 0.81 EGFR (0.53) ALDH1A1APPMEN1KMT2AFGFR2
SCHEMBL17857007 0.74 EGFR (0.55) ALDH1A1APPMEN1KMT2AFGFR2
SCHEMBL17856998 0.74 FGFR4 (0.68) FGFR4FGFR2FGFR3FGFR1
SCHEMBL17837349 0.73 MEN1 (0.51) ALDH1A1APPMEN1KMT2AFGFR2
SCHEMBL17857002 0.71 EGFR (0.53) MEN1KMT2AFGFR2TP53
SCHEMBL17856983 0.71 BTK (0.61) FGFR4FGFR2FGFR3BTKFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10906878-B2 Kinase inhibitors for the treatment of disease DANA FARBER CANCER INSTITUTE, INC. (US) 2021-02-02 US disclosed
US-20190256475-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE DANA-FARBER CANCER INSTITUTE, INC. 2019-08-22 US disclosed
US-10316002-B2 Kinase inhibitors for the treatment of disease DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-06-11 US disclosed
US-20170369449-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE DANA-FARBER CANCER INSTITUTE, INC. 2017-12-28 US disclosed
US-9783504-B2 Kinase inhibitors for the treatment of disease DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-10-10 US disclosed
US-9783504-B2 Kinase inhibitors for the treatment of disease DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-10-10 US disclosed
US-20160176825-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-23 US disclosed
US-20160176825-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-23 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 (5 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-20190256475-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE BLK, ROS1, TEC ALDH1A1 3876/4885APP 3517/4885MEN1 3935/4885
US-20170369449-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE BLK, ROS1, TEC ALDH1A1 3876/4885APP 3517/4885MEN1 3935/4885
US-10906878-B2 Kinase inhibitors for the treatment of disease BLK, ROS1, TEC ALDH1A1 3876/4885APP 3517/4885MEN1 3935/4885
US-10316002-B2 Kinase inhibitors for the treatment of disease BLK, ROS1, TEC ALDH1A1 3876/4885APP 3517/4885MEN1 3935/4885
US-20160176825-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE BLK, ROS1, TEC ALDH1A1 3876/4885APP 3517/4885MEN1 3935/4885

“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.