SCHEMBL4875325

SCHEMBL4875325

N=C(N)c1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
TAS1R2 Q8TE23 2/20 0.42
VNN1 O95497 2/20 0.42
F10 P00742 1/20 0.41
PLAU P00749 2/20 0.41
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
KLKB1 P03952 1/20 0.41
KLK1 P06870 1/20 0.41
LMNA P02545 2/20 0.41
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
PTPN7 P35236 2/20 0.40
DUSP3 P51452 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
SCHEMBL14099337 0.86 KIF11 (0.49) PRSS1PRSS2PRSS3F10PLAU
Hydrochloric Acid SCHEMBL5125320 0.85 KIF11 (0.47) PRSS1PRSS2PRSS3F10PLAU
SCHEMBL16527165 0.81 PTPN7 (0.47) TAS1R3TAS1R1TAS1R2VNN1KCNQ3
SCHEMBL273364 0.81 VNN1 (0.54) TAS1R3TAS1R1TAS1R2VNN1KCNQ3
SCHEMBL30641942 0.81 VNN1 (0.54) TAS1R3TAS1R1TAS1R2VNN1KCNQ3
SCHEMBL19479019 0.81 MAPT (0.46) PRSS1PRSS2PRSS3F10PLAU
SCHEMBL4399666 0.80 TAS1R3 (0.43) TAS1R3TAS1R1TAS1R2VNN1KCNQ3
Hydrochloric Acid SCHEMBL28325793 0.79 MAPT (0.45) PRSS1PRSS2PRSS3F10PLAU
SCHEMBL6503335 0.79 PRSS1 (0.41) PRSS1PRSS2PRSS3F10PLAU
Hydrochloric Acid SCHEMBL4372865 0.79 VNN1 (0.53) TAS1R3TAS1R1TAS1R2VNN1KCNQ3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108699041-B Imidazole derivative having JNK inhibitory activity and use thereof 三进制药株式会社 2021-03-26 CN disclosed
EP-3409668-B1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF SAMJIN PHARM CO LTD (KR) 2020-10-21 EP disclosed
US-10301291-B2 Imidazole derivative having JNK inhibitory activity and use thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2019-05-28 US disclosed
US-10301291-B2 Imidazole derivative having JNK inhibitory activity and use thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2019-05-28 US disclosed
US-20190031645-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2019-01-31 US disclosed
US-20190031645-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2019-01-31 US disclosed
EP-3409668-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2018-12-05 EP disclosed
CN-108699041-A Novel imidazole derivatives and application thereof with JNK inhibitory activity 三进制药株式会社 2018-10-23 CN disclosed
WO-2017131425-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF 한양대학교 에리카산학협력단 2017-08-03 WO disclosed
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US disclosed
EP-1794156-A2 TROMBOPOIETIN RECEPTOR AGONISTS Pfizer Products Incorporated (US) 2007-06-13 EP disclosed
WO-2006033005-A2 THROMBOPOIETIN RECEPTOR AGONISTS PFIZER PRODUCTS INC. (US) 2006-03-30 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-20190031645-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF MAPKAPK2, MAPKAPK3, MAP3K7 PRSS1 1449/4885PRSS2 1899/4885PRSS3 2210/4885
US-10301291-B2 Imidazole derivative having JNK inhibitory activity and use thereof MAPKAPK2, MAPKAPK3, MAP3K7 PRSS1 1539/4885PRSS2 1922/4885PRSS3 2299/4885
US-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R PRSS1 1912/4885PRSS2 3185/4885PRSS3 4079/4885

“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.