SCHEMBL25930978

SCHEMBL25930978

C=C(c1ccccc1COC(=O)CCCCC)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CYP4F2 P78329 1/20 0.43
▸ CYP4A11 Q02928 1/20 0.43
▸ TSHR P16473 4/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ELANE P08246 1/20 0.41
▸ LMNA P02545 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ PAM P19021 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ DGKA P23743 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 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
SCHEMBL25930983 0.99 MAPT (0.44) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL23844771 0.85 MAPT (0.47) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL23832315 0.83 KDM4E (0.55) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL17938487 0.83 CYP4F2 (0.54) CYP4F2CYP4A11TSHRTP53CYP3A4
SCHEMBL30203380 0.82 KDM4E (0.54) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL23844744 0.82 KDM4E (0.54) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL23844975 0.82 KDM4E (0.50) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL31509765 0.82 KDM4E (0.54) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL23845061 0.82 TSHR (0.48) KDM4EMEN1RECQLKMT2ACYP4F2
SCHEMBL25931956 0.82 CYP4F2 (0.46) KDM4EMEN1RECQLKMT2ACYP4F2

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-11718637-B2 Prodrugs of 4′-C-substituted-2-halo-2′- deoxyadenosine nucleosides and methods of making and using the same GILEAD SCIENCES, INC. (US) 2023-08-08 — — 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-11718637-B2 Prodrugs of 4′-C-substituted-2-halo-2′- deoxyadenosine nucleosides and methods of making and using the same DCTD, MTAP, ADA KDM4E 2522/4885MEN1 4076/4885RECQL 695/4885

“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.

Send feedback