SCHEMBL4965295

SCHEMBL4965295

O=C1c2ncc3c(c(COC[C@@H](O)CO)cn3Cc3ccc(F)cc3)c2CCN1O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ PKM P14618 1/20 0.32
▸ NCOA3 Q9Y6Q9 1/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL4964503 1.00 LMNA (0.33) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4963313 0.90 PKM (0.34) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4962824 0.86 PKM (0.33) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4962397 0.86 PKM (0.35) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4965989 0.86 SMN1; SMN2 (0.36) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4963385 0.85 MEN1 (0.36) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
Hydrochloric Acid SCHEMBL5420984 0.85 SMN1; SMN2 (0.35) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4966779 0.85 PKM (0.37) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4962798 0.85 PKM (0.34) LMNASMN1; SMN2L3MBTL1HTTALDH1A1
SCHEMBL4966404 0.85 PKM (0.33) LMNASMN1; SMN2L3MBTL1HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934220-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME Pfizer Products Incorporated (US) 2008-06-25 — — EP disclosed
US-20070099915-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC. 2007-05-03 — — US disclosed
WO-2007042883-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER PRODUCTS INC. (US) 2007-04-19 — — 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 (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-20070099915-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME IMPDH1, INTS9, TYMP LMNA 3259/4885SMN1; SMN2 4080/4885L3MBTL1 1389/4885

“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.

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