SCHEMBL858716

SCHEMBL858716

O=C(c1ccc(Cl)nc1)c1c[nH]c2ncccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.53
CNR2 P34972 1/20 0.47
CAMKK2 Q96RR4 2/20 0.47
NEK2 P51955 2/20 0.47
DYRK1A Q13627 2/20 0.45
CLK4 Q9HAZ1 2/20 0.45
DYRK1B Q9Y463 2/20 0.45
KIF20A O95235 1/20 0.45
CLK1 P49759 1/20 0.45
CLK2 P49760 1/20 0.45
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45
BRD4 O60885 1/20 0.43
KDR P35968 2/20 0.43
GPR84 Q9NQS5 1/20 0.43
CCNE1 P24864 2/20 0.43
CDK2 P24941 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NAPRT Q6XQN6 1/20 0.43

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
SCHEMBL857593 0.85 MAP2K1 (0.55) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL12646997 0.85 MAP2K1 (0.58) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL1266725 0.84 MAP2K1 (0.53) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL878925 0.83 KIF20A (0.59) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL24011615 0.82 MAP2K1 (0.53) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL27708260 0.81 MAP2K1 (0.71) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL697424 0.81 GPR84 (0.59) GPR84SMN1; SMN2NAPRTKMT2A
SCHEMBL12772764 0.81 MAP2K1 (0.58) MAP2K1CNR2CAMKK2NEK2DYRK1A
SCHEMBL878719 0.80 MAP2K1 (0.61) MAP2K1CNR2CAMKK2NEK2KDR
SCHEMBL2984625 0.80 MAP2K1 (0.61) MAP2K1CNR2CAMKK2NEK2BRD4

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 107 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190263800-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON INC. 2019-08-29 US disclosed
US-20190263800-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON INC. 2019-08-29 US disclosed
US-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2018-04-26 US disclosed
US-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2018-04-26 US disclosed
US-20170247370-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON INC. 2017-08-31 US disclosed
US-20170247370-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON INC. 2017-08-31 US disclosed
US-20170247370-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON INC. 2017-08-31 US disclosed
US-9487515-B2 Compounds modulating c-fms and/or c-kit activity and uses therefor PLEXXIKON INC. (US) 2016-11-08 US disclosed
US-9487515-B2 Compounds modulating c-fms and/or c-kit activity and uses therefor PLEXXIKON INC. (US) 2016-11-08 US disclosed
US-9487515-B2 Compounds modulating c-fms and/or c-kit activity and uses therefor PLEXXIKON INC. (US) 2016-11-08 US disclosed
EP-1755597-A2 AZAINDOLES MODULATING C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2007-02-28 EP disclosed
US-20070032519-A1 Compounds modulating c-kit and c-fms activity and uses therefor PLEXXIKON, INC. 2007-02-08 US disclosed
US-20070032519-A1 Compounds modulating c-kit and c-fms activity and uses therefor PLEXXIKON, INC. 2007-02-08 US disclosed
US-20070032519-A1 Compounds modulating c-kit and c-fms activity and uses therefor PLEXXIKON, INC. 2007-02-08 US disclosed
WO-2007013896-A2 PYRROL (2,3-B) PYRIDINE DERIVATIVES PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-02-01 WO disclosed
WO-2007013896-A2 PYRROL (2,3-B) PYRIDINE DERIVATIVES PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-02-01 WO disclosed
WO-2007002433-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 WO disclosed
US-20060058340-A1 Compounds modulating c-kit activity PLEXXIKON INC. 2006-03-16 US disclosed
US-20060058339-A1 Compounds modulating c-kit activity and uses therefor PLEXXIKON, INC. 2006-03-16 US disclosed
WO-2006009755-A2 AZAINDOLES MODULATING C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2006-01-26 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 (6 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-20170247370-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR KIT, FLT3, FLT1 MAP2K1 746/4885CNR2 2545/4885CAMKK2 345/4885
US-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 MAP2K1 153/4885CNR2 2801/4885CAMKK2 100/4885
US-20060058340-A1 Compounds modulating c-kit activity KIT, CDC7, CDK7 MAP2K1 536/4885CNR2 3121/4885CAMKK2 534/4885
US-20190263800-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR KIT, FLT3, FLT1 MAP2K1 688/4885CNR2 2674/4885CAMKK2 349/4885
US-20060058339-A1 Compounds modulating c-kit activity and uses therefor KIT, APC, RET MAP2K1 519/4885CNR2 2679/4885CAMKK2 569/4885
US-20070032519-A1 Compounds modulating c-kit and c-fms activity and uses therefor KIT, FLT3, FLT1 MAP2K1 774/4885CNR2 3286/4885CAMKK2 350/4885

“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.