SCHEMBL16445883

SCHEMBL16445883

CN(c1nc(Nc2ccc(O)cc2)ncc1F)C1CCCO1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AURKA O14965 14/20 0.48
SYK P43405 1/20 0.48
TNK2 Q07912 3/20 0.47
AURKB Q96GD4 1/20 0.44
JAK3 P52333 3/20 0.41
LCK P06239 2/20 0.40

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
SCHEMBL16446062 0.88 JAK3 (0.53) AURKASYKTNK2JAK3LCK
Hydrochloric Acid SCHEMBL16446120 0.88 TNK2 (0.53) AURKASYKTNK2JAK3LCK
SCHEMBL16445571 0.87 AURKA (0.48) AURKATNK2JAK3LCK
Hydrochloric Acid SCHEMBL16445559 0.86 TNK2 (0.56) AURKASYKTNK2JAK3LCK
SCHEMBL16445549 0.80 TNK2 (0.61) AURKASYKTNK2JAK3LCK
Hydrochloric Acid SCHEMBL16445990 0.80 TNK2 (0.54) AURKATNK2JAK3LCK
SCHEMBL16447852 0.80 TNK2 (0.67) AURKATNK2AURKBJAK3
SCHEMBL16446028 0.75 TNK2 (0.62) SYKTNK2JAK3LCK
Hydrochloric Acid SCHEMBL16445447 0.74 JAK3 (0.56) SYKTNK2JAK3LCK
SCHEMBL3289556 0.73 GSK3B (0.47) AURKASYKJAK3LCK

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-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
EP-3030241-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. Lee Moffitt Cancer Center And Research Institute, Inc. (US) 2016-06-15 EP 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 AURKA 154/4885SYK 504/4885TNK2 3/4885
US-10017478-B2 Inhibitors of ACK1/TNK2 tyrosine kinase TNK1, TNNI3K, TNK2 AURKA 154/4885SYK 504/4885TNK2 3/4885
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE TNK1, TNNI3K, TNK2 AURKA 154/4885SYK 504/4885TNK2 3/4885

“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.