SCHEMBL13432191

SCHEMBL13432191

Cc1ccc2c(c1)CN(CCO)C2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 2/20 0.44
KDM4E B2RXH2 3/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
PARP1 P09874 1/20 0.43
PARP2 Q9UGN5 1/20 0.43
HDAC6 Q9UBN7 1/20 0.41
GABRA1 P14867 1/20 0.41
DPP4 P27487 1/20 0.38
SRD5A1 P18405 1/20 0.38
USP19 O94966 1/20 0.38
METAP1 P53582 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
PARP10 Q53GL7 1/20 0.37
PARP11 Q9NR21 1/20 0.37
TP53 P04637 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL20924128 0.91 PRF1 (0.46) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL13091171 0.88 KDM4E (0.45) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL14368227 0.85 GRM5 (0.48) GRM5
SCHEMBL6440457 0.83 ADAM17 (0.47) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL1026421 0.82 GRM5 (0.44) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL29370739 0.81 PARP1 (0.46) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL3388515 0.81 KDM4E (0.51) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL2019427 0.81 PRF1 (0.44) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL3045977 0.81 PRMT5 (0.45) PRF1KDM4EALOX15TSHRSIRT1
SCHEMBL17244438 0.80 PDE5A (0.39) KDM4EALOX15TSHRSIRT1PARP1

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-2888251-B1 PERFORIN INHIBITING BENZENESULFONAMIDE COMPOUNDS, PREPARATION AND USES THEREOF PETER MACCALLUM CANCER INST (AU) 2019-04-24 EP disclosed
US-20100056524-A1 Compound MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-03-04 US disclosed
US-20100056524-A1 Compound MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-03-04 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-20100056524-A1 Compound NR3C2, NR3C1, NR2E3 PRF1 4854/4885KDM4E 2587/4885ALOX15 2183/4885

“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.