SCHEMBL19974980

SCHEMBL19974980

Cc1ccccc1CN1C(=O)CCC1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.62
GAA P10253 2/20 0.51
CYP2D6 P10635 2/20 0.50
CYP2C19 P33261 2/20 0.50
MAPT P10636 2/20 0.50
HTT P42858 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP3A4 P08684 1/20 0.48
GFER P55789 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 3/20 0.48
LMNA P02545 1/20 0.48
PKM P14618 1/20 0.45

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
SCHEMBL30062891 1.00 P2RX7 (0.62) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL19975368 0.89 P2RX7 (0.59) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL30063555 0.89 P2RX7 (0.59) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL7217950 0.84 HTT (0.48) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL16601374 0.83 P2RX7 (0.59) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL1613006 0.83 CYP2D6 (0.48) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL289312 0.83 HTT (0.65) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL1613178 0.83 HTT (0.65) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL16601376 0.83 P2RX7 (0.59) P2RX7GAACYP2D6CYP2C19MAPT
SCHEMBL1613003 0.83 CYP2D6 (0.48) P2RX7GAACYP2D6CYP2C19MAPT

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-20220356148-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2022-11-10 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
EP-3512836-A1 ANTIVIRAL COMPOUNDS Haplogen GmbH (AT) 2019-07-24 EP disclosed
WO-2018050631-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2018-03-22 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 (3 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-20190225575-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G12A, PLA2G4C P2RX7 339/4885GAA 75/4885CYP2D6 798/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C P2RX7 564/4885GAA 107/4885CYP2D6 562/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C P2RX7 339/4885GAA 75/4885CYP2D6 798/4885

“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.