SCHEMBL25875795

SCHEMBL25875795

C=C(C(=O)OCC)c1nnc(Cc2ccccc2)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.40
KDM4E B2RXH2 1/20 0.39
RNASEH1 O60930 2/20 0.39
LMNA P02545 1/20 0.38
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 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
SCHEMBL15956900 0.84 SMN1; SMN2 (0.52) ALDH1A1MAPTPDE3BPDE3ASMN1; SMN2
SCHEMBL24129894 0.77 L3MBTL1 (0.40) ALDH1A1MAPTPDE3BPDE3ASMN1; SMN2
SCHEMBL25309056 0.77 L3MBTL1 (0.40) ALDH1A1MAPTPDE3BPDE3ASMN1; SMN2
SCHEMBL18419869 0.77 KMT2A (0.43) ALDH1A1MAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL19037422 0.76 LMNA (0.49) ALDH1A1SMN1; SMN2KMT2ARNASEH1LMNA
SCHEMBL15956955 0.76 RNASEH1 (0.50) KMT2ARNASEH1LMNA
SCHEMBL21065619 0.76 ALDH1A1 (0.54) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL15964606 0.75 MMP2 (0.49) ALDH1A1MAPTPDE3BPDE3ASMN1; SMN2
Hydrochloric Acid SCHEMBL15956818 0.75 RNASEH1 (0.49) MAPTKMT2AKDM4ERNASEH1
Diphenylmethane SCHEMBL26922258 0.75 ALDH1A1 (0.56) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227435-A1 SMALL MOLECULE MODULATORS OF IL-17 LEO PHARMA A/S (DK) 2023-07-20 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-20230227435-A1 SMALL MOLECULE MODULATORS OF IL-17 IL17A, IL2, IL23R ALDH1A1 448/4885MAPT 559/4885PDE3B 266/4885

“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.