SCHEMBL16740696

SCHEMBL16740696

c1ccc2c(c1)[nH]c1nc3ncncc3nc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.59
NPC1 O15118 4/20 0.59
RAB9A P51151 4/20 0.59
TP53 P04637 2/20 0.59
CASP1 P29466 2/20 0.59
MAPK10 P53779 2/20 0.59
CASP7 P55210 2/20 0.59
POLB P06746 1/20 0.59
MAPT P10636 5/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
PLK4 O00444 1/20 0.40
CHEK1 O14757 1/20 0.40
AURKA O14965 1/20 0.40
DAPK3 O43293 1/20 0.40
CHEK2 O96017 1/20 0.40
CDK1 P06493 1/20 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
SCHEMBL27354475 0.79 NPC1 (0.68) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL30704451 0.76 SMN1; SMN2 (0.73) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL30646327 0.76 SMN1; SMN2 (0.73) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL824357 0.76 SMN1; SMN2 (0.73) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL824397 0.76 SMN1; SMN2 (0.73) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL278729 0.76 RAB9A (1.00) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL29572859 0.76 RAB9A (1.00) SMN1; SMN2NPC1RAB9ATP53CASP1
SCHEMBL16740709 0.73 NPC1 (0.68) SMN1; SMN2NPC1RAB9ATP53CASP1
Carbazole SCHEMBL10734691 0.71 GABRA1 (0.50) SMN1; SMN2AURKAPIM1GABRPGABRD
SCHEMBL2391060 0.71 GABRA1 (0.53) SMN1; SMN2MAPK1AURKAPIM1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10100053-B2 Process for the preparation of 8-(4-aminophenoxy)-4H-pyrido[2,3-b]pyrazin-3-one derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-10-16 US disclosed
EP-3074395-B1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES CANCER RESEARCH TECH LTD (GB) 2018-08-22 EP disclosed
US-20170298065-A1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-10-19 US disclosed
US-9708317-B2 Process for the preparation of 8-(4-aminophenoxy)-4H-pyrido[2,3-B]pyrazin-3-one derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-07-18 US disclosed
US-20160297814-A1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES OXY SCIENTIFIC LIMITED (GB) 2016-10-13 US disclosed
EP-3074395-A1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES Cancer Research Technology Ltd (GB) 2016-10-05 EP disclosed
WO-2015075482-A1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-05-28 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-10100053-B2 Process for the preparation of 8-(4-aminophenoxy)-4H-pyrido[2,3-b]pyrazin-3-one derivatives PAM, PDXK, GRHPR SMN1; SMN2 4510/4885NPC1 4533/4885RAB9A 3515/4885
US-20170298065-A1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES TDO2, HPD, PDXK SMN1; SMN2 4441/4885NPC1 4438/4885RAB9A 3713/4885
US-20160297814-A1 PROCESS FOR THE PREPARATION OF 8-(4-AMINOPHENOXY)-4H-PYRIDO[2,3-B]PYRAZIN-3-ONE DERIVATIVES PAM, PDXK, GRHPR SMN1; SMN2 4510/4885NPC1 4533/4885RAB9A 3515/4885

“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.