SCHEMBL20186804

SCHEMBL20186804

CC(C)(C)OC(=O)N1CCCCCC1CN

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 1/20 0.48
HPGD P15428 1/20 0.46
KDM1A O60341 1/20 0.43
EPHX1 P07099 1/20 0.43
ATM Q13315 2/20 0.43
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CHEK2 O96017 1/20 0.40
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
PREP P48147 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
SCHEMBL20214777 1.00 PDE8B (0.48) PDE8BHPGDKDM1AEPHX1ATM
SCHEMBL344947 0.98 PDE8B (0.49) PDE8BHPGDKDM1AEPHX1ATM
SCHEMBL80021 0.98 PDE8B (0.49) PDE8BHPGDKDM1AEPHX1ATM
SCHEMBL283705 0.98 PDE8B (0.49) PDE8BHPGDKDM1AEPHX1ATM
Hydrochloric Acid SCHEMBL3564519 0.97 PDE8B (0.48) PDE8BHPGDKDM1AEPHX1ATM
SCHEMBL337349 0.94 HSD17B10 (0.48) PDE8BATMHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL337037 0.94 HSD17B10 (0.48) PDE8BATMHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL205359 0.94 HSD17B10 (0.48) PDE8BATMHSD17B10SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL1026857 0.92 HSD17B10 (0.47) PDE8BATMHSD17B10SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL1027414 0.92 HSD17B10 (0.47) PDE8BATMHSD17B10SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3548495-B1 PYRAZOLOPYRIMIDINE DERIVATIVES AS CAM KINASE INHIBITORS GILEAD SCIENCES INC (US) 2021-01-27 EP disclosed
US-10100058-B2 Fused heterocyclic compounds as CaM kinase inhibitors GILEAD SCIENCES, INC. (US) 2018-10-16 US disclosed
US-20180148457-A1 FUSED HETEROCYCLIC COMPOUNDS AS CAM KINASE INHIBITORS GILEAD SCIENCES, INC. 2018-05-31 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 (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-10100058-B2 Fused heterocyclic compounds as CaM kinase inhibitors CAMK1, CAMKK1, CAMK1D PDE8B 1262/4885HPGD 1387/4885KDM1A 2725/4885
US-20180148457-A1 FUSED HETEROCYCLIC COMPOUNDS AS CAM KINASE INHIBITORS CAMK1, CAMKK1, CAMK1D PDE8B 1262/4885HPGD 1387/4885KDM1A 2725/4885

“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.