SCHEMBL15094496

SCHEMBL15094496

O=C(Nc1cccc(-c2nnn[nH]2)c1)c1cc(O)cc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 5/20 0.49
▸ MAPT P10636 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ P2RX1 P51575 2/20 0.47
▸ RHOC P08134 1/20 0.46
▸ RHOA P61586 1/20 0.46
▸ MAP3K5 Q99683 1/20 0.45
▸ KCNK3 O14649 2/20 0.45
▸ RAF1 P04049 3/20 0.43
▸ BRAF P15056 3/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ PDGFRB P09619 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ KCNK9 Q9NPC2 1/20 0.42

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
SCHEMBL15094495 0.89 PTGS1 (0.50) RXFP1MAPTLMNAMEN1RAB9A
SCHEMBL16340990 0.84 RAB9A (0.44) MAPTLMNAMEN1RAB9AKMT2A
SCHEMBL21067860 0.79 KMT2A (0.58) MAPTMEN1RAB9AKMT2ANPC1
SCHEMBL9863429 0.79 NR1H4 (0.43) MAPTMEN1RAB9AKMT2ANPC1
Water SCHEMBL9417276 0.78 NR1H4 (0.43) MAPTMEN1RAB9AKMT2ANPC1
SCHEMBL31680549 0.78 MMP2 (0.54) MAPTMEN1RAB9AKMT2ANPC1
SCHEMBL1249670 0.77 NPC1 (0.55) RXFP1MAPTMEN1RAB9AKMT2A
SCHEMBL15094744 0.77 KMT2A (0.49) RXFP1MAPTMEN1RAB9AKMT2A
SCHEMBL16341011 0.77 TEK (0.45) RXFP1MAPTP2RX1MAP3K5RAF1
SCHEMBL18430731 0.77 RXFP1 (0.53) RXFP1MAPTMAP3K5RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10604493-B2 Compositions, methods of use, and methods of treatment UNIVERSITY OF SOUTH FLORIDA (US) 2020-03-31 — — US claimed
US-10604493-B2 Compositions, methods of use, and methods of treatment UNIVERSITY OF SOUTH FLORIDA (US) 2020-03-31 — — US disclosed
US-20170088524-A1 Compositions, Methods of Use, And Methods of Treatment UNIVERSITY OF SOUTH FLORIDA 2017-03-30 — — US disclosed
US-9556131-B2 Compositions, methods of use, and methods of treatment UNIVERSITY OF SOUTH FLORIDA (US) 2017-01-31 — — US disclosed
US-9556131-B2 Compositions, methods of use, and methods of treatment UNIVERSITY OF SOUTH FLORIDA (US) 2017-01-31 — — US disclosed
US-20140378516-A1 COMPOSITIONS, METHODS OF USE, AND METHODS OF TREATMENT UNIVERSITY OF SOUTH FLORIDA 2014-12-25 — — US disclosed
EP-2800568-A1 COMPOSITIONS, METHODS OF USE, AND METHODS OF TREATMENT University Of South Florida (US) 2014-11-12 — — EP disclosed
WO-2013103760-A1 COMPOSITIONS, METHODS OF USE, AND METHODS OF TREATMENT UNIVERSITY OF SOUTH FLORIDA (US) 2013-07-11 — — 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 (3 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-20140378516-A1 COMPOSITIONS, METHODS OF USE, AND METHODS OF TREATMENT LIPA, LCT, GAA RXFP1 3847/4885MAPT 2458/4885LMNA 343/4885
US-10604493-B2 Compositions, methods of use, and methods of treatment LIPA, LCT, GAA RXFP1 3847/4885MAPT 2458/4885LMNA 343/4885
US-20170088524-A1 Compositions, Methods of Use, And Methods of Treatment LIPA, LCT, GAA RXFP1 3847/4885MAPT 2458/4885LMNA 343/4885

“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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