SCHEMBL13623962

SCHEMBL13623962

CN1Cc2c(c(O)c3ncc(Cc4ccc(F)cc4)cc3c2C(=O)NS(C)(=O)=O)C1=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 3/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CNR2 P34972 6/20 0.32
TLR2 O60603 2/20 0.32
SCN9A Q15858 2/20 0.32
SCN2B O60939 1/20 0.31
SCN1A P35498 1/20 0.31
SCN1B Q07699 1/20 0.31
SCN5A Q14524 1/20 0.31
CNR1 P21554 1/20 0.31
NTRK1 P04629 1/20 0.30
CSNK1D P48730 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
VNN1 O95497 1/20 0.30
PTGER4 P35408 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
SCHEMBL12378399 0.90 LIPG (0.36) LIPGMEN1KMT2ACNR2TLR2
SCHEMBL13623970 0.87 PTGER4 (0.32) LIPGPTGER4
SCHEMBL12378352 0.87 CSNK1D (0.33) LIPGMEN1KMT2ACNR2TLR2
SCHEMBL12378421 0.86 GPR52 (0.39) LIPGMEN1KMT2ATLR2L3MBTL1
SCHEMBL13623961 0.86 PLA2G2A (0.36) LIPGMEN1KMT2ACNR2TLR2
SCHEMBL13624013 0.86 GRM2 (0.37) LIPGTLR2CSNK1D
SCHEMBL12378401 0.86 MEN1 (0.36) LIPGMEN1KMT2ACNR2TLR2
SCHEMBL13624003 0.85 PTGER4 (0.33) LIPGNTRK1VNN1PTGER4
SCHEMBL13624054 0.85 SCN9A (0.38) LIPGKMT2ACNR2SCN9APTGER4
SCHEMBL13623964 0.85 CSNK1D (0.32) LIPGMEN1KMT2ACNR2TLR2

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-20090291921-A1 INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2009-11-26 US disclosed
US-20090291921-A1 INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2009-11-26 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-20090291921-A1 INTEGRASE INHIBITORS TYMP, DNTT, PAICS LIPG 2233/4885MEN1 4674/4885KMT2A 1657/4885

“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.