SCHEMBL20548607

SCHEMBL20548607

O=c1onc(Cc2ccc(F)cc2)n1Cc1c(F)cccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 2/20 0.43
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.42
PKM P14618 1/20 0.42
CYP2A13 Q16696 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL30314550 1.00 ALDH1A1 (0.46) ALDH1A1HTTLMNAMAPTTP53
SCHEMBL30314263 0.92 LMNA (0.52) ALDH1A1HTTLMNAMAPTTP53
SCHEMBL20548689 0.92 LMNA (0.52) ALDH1A1HTTLMNAMAPTTP53
SCHEMBL20548652 0.92 ALDH1A1 (0.50) ALDH1A1HTTLMNAMAPTTP53
SCHEMBL30314486 0.92 ALDH1A1 (0.50) ALDH1A1HTTLMNAMAPTTP53
SCHEMBL20548631 0.89 LMNA (0.44) ALDH1A1LMNAMAPTTP53PKM
SCHEMBL30314345 0.89 LMNA (0.44) ALDH1A1LMNAMAPTTP53PKM
SCHEMBL30314402 0.89 LMNA (0.44) ALDH1A1LMNAMAPTTP53PKM
SCHEMBL20548680 0.89 LMNA (0.44) ALDH1A1LMNAMAPTTP53PKM
SCHEMBL20548636 0.86 MAPT (0.43) ALDH1A1LMNAMAPTTP53CYP2A13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11623919-B2 Heterocyclic P2X7 antagonists BREYE THERAPEUTICS APS (DK) 2023-04-11 US claimed
EP-3619200-A1 HETEROCYCLIC P2X7 ANTAGONISTS AXXAM S.p.A. (IT) 2020-03-11 EP claimed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US claimed
WO-2018202694-A1 HETEROCYCLIC P2X7 ANTAGONISTS AXXAM S.P.A. (IT) 2018-11-08 WO claimed
US-11623919-B2 Heterocyclic P2X7 antagonists BREYE THERAPEUTICS APS (DK) 2023-04-11 US disclosed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US disclosed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US disclosed
EP-3398941-A1 HETEROCYCLIC P2X7 ANTAGONISTS AXXAM S.p.A. (IT) 2018-11-07 EP 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-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS P2RY1, P2RX1, P2RX3 ALDH1A1 1689/4885HTT 835/4885LMNA 2079/4885
US-11623919-B2 Heterocyclic P2X7 antagonists P2RY1, P2RX1, P2RX3 ALDH1A1 1689/4885HTT 835/4885LMNA 2079/4885

“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.