SCHEMBL19148196

SCHEMBL19148196

FC(F)c1cc(C(F)F)c2cc(OC(F)(F)F)ccc2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 2/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SCN4A P35499 2/20 0.41
▸ SCN9A Q15858 2/20 0.41
▸ GMNN O75496 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ PMP22 Q01453 1/20 0.41

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
SCHEMBL19149253 0.88 NPC1 (0.38) DHODHNPC1RAB9ASCN4ASCN9A
SCHEMBL19149164 0.84 IGF1R (0.44) DHODHNPC1RAB9ASCN4ASCN9A
SCHEMBL19148973 0.82 KDM4E (0.43) NPC1RAB9ALMNAGAASMN1; SMN2
SCHEMBL19148954 0.77 CCNE2 (0.41) DHODHSCN4AAAK1KDM4E
SCHEMBL19150073 0.74 DHODH (0.37) DHODHGAAACHEKDM4E
SCHEMBL19148219 0.72 ADORA2A (0.42) NPC1RAB9ASCN4ASCN9AGMNN
SCHEMBL27248603 0.71 DHODH (0.47) DHODHNPC1RAB9ASCN4ASCN9A
SCHEMBL3291837 0.71 TDP1 (0.43) RAB9ALMNATP53CYP1A2ADORA3
SCHEMBL19148957 0.70 PDE3B (0.43) APPKDM4E
SCHEMBL19148598 0.70 KDM4E (0.41) NPC1RAB9ALMNACYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10266494-B2 Process for the preparation of polyfluoroalkylated quinolines BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-04-23 — — US disclosed
US-20190023659-A1 PROCESS FOR THE PREPARATION OF POLYFLUOROALKYLATED QUINOLINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-01-24 — — US disclosed
EP-3405458-A1 PROCESS FOR THE PREPARATION OF POLYFLUOROALKYLATED QUINOLINES Bayer CropScience Aktiengesellschaft (DE) 2018-11-28 — — EP disclosed
CN-108473433-A The method for preparing the quinoline of Polyfluoroalkyl 拜耳作物科学股份公司 2018-08-31 — — CN disclosed
WO-2017125318-A1 PROCESS FOR THE PREPARATION OF POLYFLUOROALKYLATED QUINOLINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-07-27 — — 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 (2 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-20190023659-A1 PROCESS FOR THE PREPARATION OF POLYFLUOROALKYLATED QUINOLINES KCNQ1, KCNQ2, KCNQ4 DHODH 1111/4885NPC1 1228/4885RAB9A 978/4885
US-10266494-B2 Process for the preparation of polyfluoroalkylated quinolines KCNQ1, KCNQ2, KCNQ4 DHODH 1111/4885NPC1 1228/4885RAB9A 978/4885

“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.

Send feedback