SCHEMBL17837345

SCHEMBL17837345

C=CC(=O)N1CCCC1C(=O)Nc1cc2c(N(C)C(=O)NCc3ccccc3)ncnc2cc1OC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.53
KDR P35968 3/20 0.53
RAF1 P04049 2/20 0.53
ERBB2 P04626 2/20 0.53
FGFR2 P21802 2/20 0.53
FLT4 P35916 2/20 0.53
TEK Q02763 2/20 0.53
ABL1 P00519 1/20 0.53
LCK P06239 1/20 0.53
RET P07949 1/20 0.53
SRC P12931 1/20 0.53
FLT1 P17948 1/20 0.51
APP P05067 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TP53 P04637 1/20 0.45
CYP3A4 P08684 5/20 0.43
CYP2C9 P11712 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
SCHEMBL17837344 1.00 EGFR (0.53) EGFRKDRRAF1ERBB2FGFR2
SCHEMBL17837349 0.93 MEN1 (0.51) EGFRKDRRAF1ERBB2FGFR2
SCHEMBL17857007 0.90 EGFR (0.55) EGFRKDRRAF1ERBB2FGFR2
SCHEMBL17857002 0.90 EGFR (0.53) EGFRKDRRAF1ERBB2FGFR2
SCHEMBL16370416 0.88 MEN1 (0.48) EGFRAPPALDH1A1MEN1KMT2A
SCHEMBL17837337 0.88 MEN1 (0.48) EGFRAPPALDH1A1MEN1KMT2A
SCHEMBL16370684 0.82 EGFR (0.47) EGFRKDRERBB2SRC
SCHEMBL16370691 0.82 EGFR (0.47) EGFRKDRERBB2SRC
SCHEMBL17857008 0.81 ALDH1A1 (0.54) FGFR2APPALDH1A1MEN1KMT2A
SCHEMBL17856995 0.81 ALDH1A1 (0.54) FGFR2APPALDH1A1MEN1KMT2A

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
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-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 EGFR 24/4885KDR 231/4885RAF1 121/4885
US-20170369449-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE BLK, ROS1, TEC EGFR 24/4885KDR 231/4885RAF1 121/4885
US-10906878-B2 Kinase inhibitors for the treatment of disease BLK, ROS1, TEC EGFR 24/4885KDR 231/4885RAF1 121/4885
US-10316002-B2 Kinase inhibitors for the treatment of disease BLK, ROS1, TEC EGFR 24/4885KDR 231/4885RAF1 121/4885
US-20160176825-A1 KINASE INHIBITORS FOR THE TREATMENT OF DISEASE BLK, ROS1, TEC EGFR 24/4885KDR 231/4885RAF1 121/4885

“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.