SCHEMBL11944

SCHEMBL11944

CS(=O)(=O)C(CCC(N)=O)c1ccc(OCc2nc(-c3cccnc3)no2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.53
▸ POLB P06746 1/20 0.53
▸ PSMB5 P28074 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ PSMB8 P28062 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TSHR P16473 3/20 0.45
▸ ATM Q13315 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ FFAR1 O14842 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ PKM P14618 1/20 0.44
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 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
SCHEMBL5861 0.90 FFAR1 (0.56) MAPTALDH1A1TSHRFFAR1SMN1; SMN2
SCHEMBL11942 0.81 PSMB5 (0.55) MAPTPOLBPSMB5KDM4EPSMB8
SCHEMBL11898794 0.80 ADAMTS4 (0.47) KMT2ASMN1; SMN2RAB9A
SCHEMBL5949 0.77 FFAR1 (0.38) MAPTTSHRFFAR1SMN1; SMN2RAB9A
SCHEMBL11328 0.76 SRC (0.41) MAPTLMNAFFAR1SMN1; SMN2
SCHEMBL6110 0.74 ADAM17 (0.49) MAPTPOLBKMT2ATSHRLMNA
SCHEMBL11943 0.74 FFAR1 (0.54) MAPTPOLBPSMB5KDM4EPSMB8
SCHEMBL5798 0.74 CYP27B1 (0.46) —
SCHEMBL4107632 0.73 RAB9A (0.76) MAPTPOLBKDM4EALDH1A1KMT2A
SCHEMBL5959943 0.73 RAB9A (0.73) MAPTPOLBKDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140364398-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents PFIZER INC. (US) 2014-12-11 — — US disclosed
US-8853258-B2 C-linked hydroxamic acid derivatives useful as antibacterial agents PFIZER INC. (US) 2014-10-07 — — US disclosed
EP-2488489-A2 C-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS Pfizer Inc. (US) 2012-08-22 — — EP disclosed
US-20120202777-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents BROWN MATTHEW FRANK (US) 2012-08-09 — — US disclosed
WO-2011045703-A2 C-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS PFIZER INC. (US) 2011-04-21 — — 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 (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-20120202777-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents HAX1, LPXN, AGXT MAPT 4745/4885POLB 1774/4885PSMB5 2563/4885
US-20140364398-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents LCT, AGXT, PRXL2A MAPT 4708/4885POLB 2631/4885PSMB5 2324/4885

“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