SCHEMBL18083760

SCHEMBL18083760

Cc1cnc(NC(=O)c2ccccc2C(F)(F)F)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.53
▸ HCRTR1 O43613 1/20 0.52
▸ GAA P10253 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ SORT1 Q99523 2/20 0.49
▸ KCNK3 O14649 3/20 0.48
▸ KCNK9 Q9NPC2 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ GLA P06280 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ PTGS1 P23219 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ SRC P12931 1/20 0.47
▸ RECQL P46063 1/20 0.46
▸ F2R P25116 1/20 0.45

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
SCHEMBL20601792 0.83 PTGES (0.52) PTGESHCRTR1GAALMNASORT1
SCHEMBL31585802 0.83 PTGES (0.52) PTGESHCRTR1GAALMNASORT1
SCHEMBL31585832 0.82 ABL1 (0.53) PTGESHCRTR1GAALMNAKCNK3
SCHEMBL17017416 0.81 HCRTR1 (0.80) HCRTR1
SCHEMBL30416485 0.81 SORT1 (0.72) SORT1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL26405724 0.80 SORT1 (0.54) PTGESGAALMNASORT1KCNK3
SCHEMBL30416204 0.80 DEGS1 (0.60) PTGESHCRTR1GAALMNAKCNK3
Hydrochloric Acid SCHEMBL30416671 0.80 SORT1 (0.70) SORT1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL26405742 0.79 PTGES (0.51) PTGESGAALMNASORT1KCNK3
SCHEMBL25383706 0.78 PTGS1 (0.61) PTGESHCRTR1GAALMNAKCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3271348-B1 NEW FYN KINASE INHIBITORS Rottapharm Biotech Srl (IT) 2019-01-30 — — EP disclosed
US-20180111919-A1 NEW FYN KINASE INHIBITORS ROTTAPHARM BIOTECH S.R.L. (IT) 2018-04-26 — — US disclosed
WO-2016146220-A1 NEW FYN KINASE INHIBITORS ROTTAPHARM BIOTECH S.R.L. (IT) 2016-09-22 — — WO disclosed
EP-3070084-A1 NEW FYN KINASE INHIBITORS Rottapharm Biotech S.r.l. (IT) 2016-09-21 — — 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 (1 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-20180111919-A1 NEW FYN KINASE INHIBITORS FYN, LCK, LYN PTGES 860/4885HCRTR1 4038/4885GAA 3549/4885

“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.

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