SCHEMBL13536645

SCHEMBL13536645

CSc1cccc(CP(C)(C)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
POLB P06746 2/20 0.39
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 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
SCHEMBL95654 0.76 MAPT (0.45) MAPTRECQLMEN1KMT2APOLB
SCHEMBL11919054 0.75 MGLL (0.42) MAPTALDH1A1TP53MAPK1SMN1; SMN2
SCHEMBL15219286 0.75 TAAR1 (0.48) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL5022962 0.74 SIGMAR1 (0.50) MAPTRECQLMEN1KMT2ATP53
SCHEMBL5180784 0.73 MAPT (0.43) MAPTRECQLMEN1KMT2APOLB
SCHEMBL1295549 0.73 MAPT (0.43) MAPTRECQLMEN1KMT2APOLB
SCHEMBL2030119 0.73 MAOB (0.48) RECQLTP53
SCHEMBL7827695 0.72 MAPT (0.41) MAPTRECQLMEN1KMT2APOLB
SCHEMBL4597601 0.72 MAPT (0.41) MAPTRECQLMEN1KMT2APOLB
SCHEMBL7050271 0.72 PNMT (0.48) MAPTALDH1A1SMN1; SMN2

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-7649015-B2 Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds GILEAD SCIENCES, INC. (US) 2010-01-19 US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 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-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 MAPT 1076/4885RECQL 2157/4885MEN1 3990/4885

“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.