SCHEMBL18860366

SCHEMBL18860366

Nc1ccc(-c2c(Cl)ccnc2N)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 1/20 0.39
KIT P10721 2/20 0.38
AXL P30530 1/20 0.35
MERTK Q12866 1/20 0.35
CYP3A4 P08684 2/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPK14 Q16539 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
MAP4K4 O95819 2/20 0.33
EGFR P00533 1/20 0.33
AURKB Q96GD4 2/20 0.33
AURKA O14965 1/20 0.33

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
SCHEMBL24391197 0.84 KIT (0.39) EPHB4KITAXLMERTKCYP3A4
SCHEMBL15334430 0.77 KIT (0.53) KITAXLMERTKTSHRKDM4E
SCHEMBL24391199 0.72 KIT (0.42) KITALDH1A1MAPK14ALOX5APFEN1
SCHEMBL24391179 0.72 GAA (0.40) KITCYP3A4TSHRGAAALOX5AP
SCHEMBL18861122 0.72 KDR (0.45) EPHB4CYP3A4KDM4ENPC1ALDH1A1
SCHEMBL18860442 0.71 EPHB4 (0.42) EPHB4KITAXLMERTKCYP3A4
SCHEMBL13385808 0.70 TSHR (0.41) KITCYP3A4TSHRKDM4ENPC1
SCHEMBL240923 0.70
SCHEMBL7607008 0.70 ITGB2 (0.42) KITCYP3A4TSHRKDM4EALDH1A1
SCHEMBL3529866 0.70 KDR (0.62) EPHB4KITAXLMAP4K4AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220002277-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYLMETHYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-01-06 US disclosed
US-11208403-B2 Pyridone derivatives having tetrahydropyranylmethyl groups DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-12-28 US disclosed
EP-3168219-B1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYL METHYL GROUP DAIICHI SANKYO CO LTD (JP) 2021-03-31 EP disclosed
US-10442797-B2 Pyridone derivatives having tetrahydropyranylmethyl groups DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-10-15 US disclosed
US-20180148436-A2 PYRIDONE DERIVATIVES HAVING TETRAHYDROPYRANYLMETHYL GROUPS DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-05-31 US disclosed
US-20180148436-A2 PYRIDONE DERIVATIVES HAVING TETRAHYDROPYRANYLMETHYL GROUPS DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-05-31 US disclosed
US-20170183329-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYLMETHYL GROUP DAIICHI SANKYO CO LTD (JP) 2017-06-29 US disclosed
US-20170183329-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYLMETHYL GROUP DAIICHI SANKYO CO LTD (JP) 2017-06-29 US disclosed
EP-3168219-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYL METHYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-05-17 EP 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-20220002277-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYLMETHYL GROUP AXL, TYRO3, LCK EPHB4 897/4885KIT 1770/4885AXL 1/4885
US-10442797-B2 Pyridone derivatives having tetrahydropyranylmethyl groups AXL, TYRO3, PDXK EPHB4 641/4885KIT 1988/4885AXL 1/4885
US-20170183329-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYLMETHYL GROUP AXL, TYRO3, PDXK EPHB4 751/4885KIT 1891/4885AXL 1/4885
US-11208403-B2 Pyridone derivatives having tetrahydropyranylmethyl groups AXL, TYRO3, PDXK EPHB4 641/4885KIT 1988/4885AXL 1/4885
US-20180148436-A2 PYRIDONE DERIVATIVES HAVING TETRAHYDROPYRANYLMETHYL GROUPS AXL, TYRO3, PDXK EPHB4 641/4885KIT 1988/4885AXL 1/4885

“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.