SCHEMBL19667626

SCHEMBL19667626

C[C@H]1COc2cccc(OCc3ccccc3)c2C(=O)N1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.41
CREBBP Q92793 2/20 0.41
KLK7 P49862 7/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
PRKCA P17252 1/20 0.38
FFAR1 O14842 1/20 0.38
NAAA Q02083 1/20 0.37
KLK5 Q9Y337 5/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TLR9 Q9NR96 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
AGTR2 P50052 1/20 0.36
PRSS1 P07477 2/20 0.36
PRSS2 P07478 2/20 0.36
PRSS3 P35030 2/20 0.36
PDE4B Q07343 1/20 0.36
CFD P00746 1/20 0.35
F11 P03951 1/20 0.35

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
SCHEMBL20873489 0.88 BRD4 (0.43) BRD4CREBBPMAOAMAOBPRKCA
SCHEMBL20873490 0.88 BRD4 (0.43) BRD4CREBBPMAOAMAOBPRKCA
SCHEMBL19684910 0.86 KLK7 (0.39) KLK7FFAR1NAAAKLK5PRSS1
SCHEMBL19684899 0.85 PRKCA (0.38) KLK7PRKCAKLK5MEN1KMT2A
SCHEMBL19667670 0.82 KLK7 (0.42) KLK7FFAR1TLR9TLR7AGTR2
SCHEMBL19679355 0.79 MAOA (0.42) BRD4CREBBPKLK7MAOAMAOB
SCHEMBL19667625 0.73 MAOA (0.40) BRD4CREBBPMAOAMAOBPRKCA
SCHEMBL20873486 0.72 FFAR1 (0.42) BRD4FFAR1AGTR2PDE4BCFD
SCHEMBL20873484 0.72 FFAR1 (0.42) BRD4FFAR1AGTR2PDE4BCFD
SCHEMBL19667141 0.71 CREBBP (0.48) BRD4CREBBPMAOAMAOBFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464249-B1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2021-08-11 EP disclosed
US-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2020-07-14 US disclosed
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2019-04-18 US disclosed
US-10220037-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2019-03-05 US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 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 (4 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-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents DUT, NCL, TYMP BRD4 2445/4885CREBBP 3271/4885KLK7 3842/4885
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP BRD4 2445/4885CREBBP 3271/4885KLK7 3842/4885
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP BRD4 2445/4885CREBBP 3271/4885KLK7 3842/4885
US-10220037-B2 Substituted carbonucleoside derivatives useful as anticancer agents DUT, NCL, TYMP BRD4 2445/4885CREBBP 3271/4885KLK7 3842/4885

“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.