SCHEMBL4048237

SCHEMBL4048237

CC1(C)Cc2c(NCCc3ccccc3)nc3sc(C(N)=O)c(N)c3c2C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
MAPT P10636 2/20 0.45
LIMK1 P53667 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 2/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
EEF2K O00418 4/20 0.44
IKBKB O14920 1/20 0.42
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.42
PLA2G1B P04054 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42

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
SCHEMBL5013088 0.88 KDM4E (0.55) ALDH1A1KDM4EMAPTSMN1; SMN2HTT
SCHEMBL4049072 0.85 CDK8 (0.48) ALDH1A1KDM4EMAPTSMN1; SMN2HTT
SCHEMBL4048241 0.78 HTT (0.47) ALDH1A1KDM4EMAPTLIMK1SMN1; SMN2
SCHEMBL4047805 0.77 EEF2K (0.50) KDM4EMAPTHTTEEF2K
SCHEMBL4049234 0.73 KDM4E (0.49) ALDH1A1KDM4ESMN1; SMN2RXFP1HPGD
SCHEMBL4049419 0.72 PDE4B (0.47) ALDH1A1KDM4EMAPTHTTRXFP1
SCHEMBL5236328 0.71 ALDH1A1 (0.66) ALDH1A1KDM4EMAPTLIMK1SMN1; SMN2
SCHEMBL4052293 0.70 KDM4E (0.53) ALDH1A1KDM4EMAPTLIMK1SMN1; SMN2
SCHEMBL5013092 0.70 KDM4E (0.55) ALDH1A1KDM4EMAPTLIMK1SMN1; SMN2
SCHEMBL4054324 0.70 KDM4E (0.69) ALDH1A1KDM4EMAPTHTTGLA

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-1819710-B1 NEW PYRIDOTHIENOPYRIMIDINE DERIVATIVES ALMIRALL LAB (ES) 2009-03-11 EP disclosed
US-20090029955-A1 Pyridothienopyrimidine Derivatives ALMIRALL PRODESFARMA S.A. (ES) 2009-01-29 US disclosed
EP-1819710-A1 NEW PYRIDOTHIENOPYRIMIDINE DERIVATIVES Laboratorios Almirall, S.A. (ES) 2007-08-22 EP disclosed
WO-2006058724-A1 NEW PYRIDOTHIENOPYRIMIDINE DERIVATIVES LABORATORIOS ALMIRALL, S.A. (ES) 2006-06-08 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 (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-20090029955-A1 Pyridothienopyrimidine Derivatives PNPO, PDE4A, DPYD ALDH1A1 391/4885KDM4E 1600/4885MAPT 2618/4885

“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.