SCHEMBL19087037

SCHEMBL19087037

CCCCCCCC(CCCCCCC)NCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.51
EPHX2 P34913 2/20 0.49
CSNK1E P49674 1/20 0.47
CNR2 P34972 1/20 0.46
SIGMAR1 Q99720 6/20 0.46
FAAH O00519 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
SCHEMBL22363311 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL11702193 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL7065867 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL18741386 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL11349595 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL23634016 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL1091520 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
SCHEMBL1090569 1.00 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2SIGMAR1
Hydrochloric Acid SCHEMBL11489605 0.98 TLR2 (0.50) TLR2EPHX2CSNK1ECNR2SIGMAR1
Hydrochloric Acid SCHEMBL1485808 0.98 TLR2 (0.50) TLR2EPHX2CSNK1ECNR2SIGMAR1

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-10844032-B2 Substituted benzofuran, benzothiophene and indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2020-11-24 US disclosed
US-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION 2017-07-06 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 (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-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB TLR2 3034/4885EPHX2 4188/4885CSNK1E 373/4885
US-10844032-B2 Substituted benzofuran, benzothiophene and indole Mcl-1 inhibitors MCL1, BCL2L1, BCLAF1 TLR2 2491/4885EPHX2 4485/4885CSNK1E 1642/4885

“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.