SCHEMBL20117027

SCHEMBL20117027

CCOc1cnc(C#N)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
PDE10A Q9Y233 1/20 0.41
SRC P12931 2/20 0.40
CHEK1 O14757 1/20 0.40
ENPP1 P22413 1/20 0.39
TSHR P16473 1/20 0.38
EGFR P00533 2/20 0.38

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
SCHEMBL21749932 0.93 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL20676395 0.81 CHEK1 (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL21045855 0.79 CHEK1 (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL30439920 0.79 CHEK1 (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL29040356 0.79 KDM4E (0.38) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL20116484 0.78 CHEK1 (0.44) PDE4DKDM4EMAPTALDH1A1GAA
SCHEMBL19117503 0.77 P2RX3 (0.43) MEN1KMT2AGAAPDE10ACHEK1
SCHEMBL14136594 0.77 SRC (0.39) KDM4EHPGDALDH1A1GAASRC
SCHEMBL21045734 0.77 POLB (0.49) KDM4EMAPTHPGDALDH1A1GAA
SCHEMBL30440463 0.77 POLB (0.49) KDM4EMAPTHPGDALDH1A1GAA

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-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 PDE4A 298/4885PDE4B 180/4885PDE4C 328/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 PDE4A 298/4885PDE4B 180/4885PDE4C 328/4885

“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.