SCHEMBL21902736

SCHEMBL21902736

CCCC(=O)N1CCCC1C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PKM P14618 1/20 0.53
FKBP1A P62942 1/20 0.52
POLB P06746 1/20 0.51
ACE P12821 2/20 0.48
ALDH1A1 P00352 2/20 0.47
PEPD P12955 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALOX5 P09917 1/20 0.43
XPNPEP1 Q9NQW7 1/20 0.43

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
SCHEMBL19192922 1.00 LMNA (0.53) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL5491765 0.89 LMNA (0.54) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL5491755 0.89 LMNA (0.54) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL6882664 0.89 LMNA (0.54) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL31159664 0.88 LMNA (0.49) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL18796576 0.88 LMNA (0.49) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL26199256 0.87 LMNA (0.53) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL26199184 0.87 LMNA (0.53) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL4179454 0.87 FKBP1A (0.55) LMNARAB9ASMN1; SMN2PKMFKBP1A
SCHEMBL13662643 0.87 FKBP1A (0.55) LMNARAB9ASMN1; SMN2PKMFKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014941-B2 Pyrrolopyrimidine derivatives useful as inhibitors of influenza virus replication COCRYSTAL PHARMA, INC. (US) 2021-05-25 US disclosed
US-20200123177-A1 PYRROLOPYRIMIDINE DERIVATIVES USEFUL AS INHIBITORS OF INFLUENZA VIRUS REPLICATION COCRYSTAL PHARMA, INC. 2020-04-23 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 (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-11014941-B2 Pyrrolopyrimidine derivatives useful as inhibitors of influenza virus replication ITPA, POLR2H, POLR2E LMNA 4249/4885RAB9A 1737/4885SMN1; SMN2 2913/4885
US-20200123177-A1 PYRROLOPYRIMIDINE DERIVATIVES USEFUL AS INHIBITORS OF INFLUENZA VIRUS REPLICATION ITPA, POLR2H, POLR2E LMNA 4249/4885RAB9A 1737/4885SMN1; SMN2 2913/4885

“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.