SCHEMBL16299335

SCHEMBL16299335

CCCCOc1c(Br)c(C(C)OC)c(F)c(C)c1C(=O)Oc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.36
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
LMNA P02545 4/20 0.34
CYP1A2 P05177 3/20 0.34
CYP2C19 P33261 3/20 0.34
KMT2A Q03164 2/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP2C9 P11712 2/20 0.34
TSHR P16473 1/20 0.34
NPC1 O15118 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 2/20 0.32
NFKB1 P19838 2/20 0.32
NFKB2 Q00653 2/20 0.32
RELA Q04206 2/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL16299327 0.91 FAAH (0.37) FAAHALOX5PPARGPPARALMNA
SCHEMBL18602758 0.91 FAAH (0.39) FAAHALOX5PPARGPPARALMNA
SCHEMBL9289071 0.90 LMNA (0.38) FAAHALOX5PPARGPPARALMNA
SCHEMBL10262710 0.89 FAAH (0.37) FAAHALOX5PPARGPPARALMNA
SCHEMBL16299399 0.88 FAAH (0.36) FAAHALOX5PPARGPPARALMNA
SCHEMBL13082802 0.86 FAAH (0.35) FAAHALOX5PPARGPPARALMNA
SCHEMBL16299401 0.84 FAAH (0.36) FAAHALOX5PPARGPPARALMNA
SCHEMBL17849907 0.83 LMNA (0.36) FAAHLMNAKMT2AL3MBTL1TSHR
SCHEMBL9290215 0.83 ALDH1A1 (0.34) FAAHLMNACYP1A2KMT2ACYP2C9
SCHEMBL17849906 0.83 FAAH (0.33) FAAHLMNAKMT2AMAPK1TSHR

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
US-9371283-B2 Polycyclic tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2016-06-21 US disclosed
US-9315451-B2 Tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2016-04-19 US disclosed
US-20120135968-A1 Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-31 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-20120135968-A1 Tetracycline Compounds TUBB, TUBA1C, TUBA1A FAAH 4449/4885ALOX5 4070/4885PPARG 2568/4885

“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.