SCHEMBL16453380

SCHEMBL16453380

O=C(Nc1c(F)cccc1Cl)c1cnc(Nc2ccc(O)c(Cl)c2)nc1NCC1CCCO1

nearest known ligand 0.85

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 18/20 0.85
JAK2 O60674 2/20 0.48
JAK1 P23458 1/20 0.48
JAK3 P52333 1/20 0.48
CHEK1 O14757 1/20 0.45
ABL1 P00519 1/20 0.45
LCK P06239 1/20 0.45
ROS1 P08922 1/20 0.45
FGFR1 P11362 1/20 0.45
SRC P12931 1/20 0.45
TYK2 P29597 1/20 0.45
ALK Q9UM73 1/20 0.45
SIK1 P57059 1/20 0.45
SIK2 Q9H0K1 1/20 0.45
SIK3 Q9Y2K2 1/20 0.45

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
Hydrochloric Acid SCHEMBL16446162 0.99 TNK2 (0.84) TNK2JAK2JAK1JAK3CHEK1
SCHEMBL16453409 0.96 TNK2 (0.85) TNK2JAK2JAK1JAK3CHEK1
Hydrochloric Acid SCHEMBL16446360 0.95 TNK2 (0.84) TNK2JAK2JAK1JAK3SIK1
SCHEMBL16453381 0.94 TNK2 (0.81) TNK2JAK2JAK1JAK3CHEK1
Hydrochloric Acid SCHEMBL16445850 0.93 TNK2 (0.80) TNK2JAK2JAK1JAK3CHEK1
SCHEMBL16447853 0.92 TNK2 (1.00) TNK2JAK2JAK1JAK3CHEK1
SCHEMBL20233956 0.88 TNK2 (0.85) TNK2JAK2JAK1JAK3CHEK1
SCHEMBL16447728 0.88 TNK2 (0.84) TNK2JAK2JAK1JAK3CHEK1
SCHEMBL16447895 0.86 TNK2 (1.00) TNK2JAK2CHEK1ABL1LCK
SCHEMBL16445171 0.86 TNK2 (1.00) TNK2JAK2JAK1JAK3CHEK1

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
US-10017478-B2 Inhibitors of ACK1/TNK2 tyrosine kinase H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2018-07-10 US disclosed
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2018-06-07 US disclosed
US-9850216-B2 Inhibitors of ACK1/TNK2 tyrosine kinase H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2017-12-26 US disclosed
US-20160176826-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-23 US disclosed
WO-2015021149-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2015-02-12 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 (3 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-20160176826-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE TNK1, TNNI3K, TNK2 TNK2 3/4885JAK2 597/4885JAK1 604/4885
US-10017478-B2 Inhibitors of ACK1/TNK2 tyrosine kinase TNK1, TNNI3K, TNK2 TNK2 3/4885JAK2 597/4885JAK1 604/4885
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE TNK1, TNNI3K, TNK2 TNK2 3/4885JAK2 597/4885JAK1 604/4885

“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.