SCHEMBL19639760

SCHEMBL19639760

CCOC(=O)c1c(C(C)Br)n(C)n(-c2cccc(C(F)(F)F)c2)c1=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 4/20 0.44
APP P05067 1/20 0.44
ADORA1 P30542 1/20 0.44
CYP2C9 P11712 3/20 0.43
KDM4E B2RXH2 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
ELANE P08246 4/20 0.42
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
GSR P00390 1/20 0.39

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
SCHEMBL19639794 0.91 MAPT (0.47) MAPTTP53ALDH1A1APPADORA1
SCHEMBL19639781 0.83 MAPT (0.49) MAPTTP53ALDH1A1APPADORA1
SCHEMBL19639762 0.82 MAPT (0.48) MAPTTP53ALDH1A1APPADORA1
SCHEMBL27644675 0.77 CYP2C9 (0.47) MAPTTP53ALDH1A1APPADORA1
SCHEMBL19639823 0.76 ALDH1A1 (0.47) MAPTTP53ALDH1A1APPADORA1
SCHEMBL19684701 0.76 MAPT (0.46) MAPTTP53ALDH1A1APPADORA1
SCHEMBL19639773 0.74 ELANE (0.53) CYP2C9ELANECYP3A4
SCHEMBL19640024 0.72 ELANE (0.54) CYP2C9ELANECYP3A4
SCHEMBL19639807 0.72 ELANE (0.48) CYP2C9ELANECYP3A4
SCHEMBL19688357 0.71 ALDH1A1 (0.46) MAPTTP53ALDH1A1APPADORA1

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
EP-3464269-B1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF A HNE RELATED DISEASE CHIESI FARM SPA (IT) 2020-04-01 EP disclosed
WO-2017207433-A9 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF A DISEASE IN WHICH HNE IS IMPLICATED CHIESI FARMACEUTICI S.P.A. (IT) 2018-03-01 WO disclosed
US-9862706-B2 Compounds CHIESI FARMACEUTICI S.P.A. (IT) 2018-01-09 US disclosed
WO-2017207433-A1 HETETOCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF A DISEASE IN WHICH HNE IS IMPLICATED CHIESI FARMACEUTICI S.P.A. (IT) 2017-12-07 WO disclosed
US-20170342056-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US disclosed
US-20170342056-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US disclosed
US-20170342056-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US 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-20170342056-A1 NOVEL COMPOUNDS SERPINB1, ELANE, MPO MAPT 4326/4885TP53 3547/4885ALDH1A1 98/4885

“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.