SCHEMBL20116607

SCHEMBL20116607

CCOc1cnc(/C(N)=N/O)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.47
TRPC6 Q9Y210 1/20 0.44
MAPK1 P28482 1/20 0.43
GAA P10253 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
P2RX3 P56373 1/20 0.39
P2RX2 Q9UBL9 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RECQL P46063 1/20 0.39
TSHR P16473 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL22367073 1.00 NPSR1 (0.47) NPSR1TRPC6MAPK1GAAKDM4E
SCHEMBL30506270 0.81 NPSR1 (0.44) NPSR1TRPC6MAPK1SMN1; SMN2PDE4A
SCHEMBL1425473 0.80 RECQL (0.41) NPSR1GAASMN1; SMN2PDE4APDE4B
SCHEMBL21045701 0.76 TSHR (0.55) TRPC6MAPK1KDM4EMAPTTSHR
SCHEMBL21045659 0.75 TRPC6 (0.48) NPSR1TRPC6MAPK1KDM4EMAPT
SCHEMBL20116265 0.74 MAPK1 (0.68) MAPK1GAAKDM4EMAPTSMN1; SMN2
SCHEMBL29040322 0.74 MAPK1 (0.68) MAPK1GAAKDM4EMAPTSMN1; SMN2
SCHEMBL29040358 0.73 TRPC6 (0.46) TRPC6MAPK1GAAMAPTSMN1; SMN2
SCHEMBL20116727 0.72 NPSR1 (0.40) NPSR1MAPK1GAAKDM4EMAPT
SCHEMBL20116736 0.72 GAA (0.44) NPSR1MAPK1GAAMAPTPDE4A

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
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
EP-3700934-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2020-09-02 EP 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 NPSR1 386/4885TRPC6 914/4885MAPK1 4304/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 NPSR1 386/4885TRPC6 914/4885MAPK1 4304/4885

“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.