SCHEMBL9286288

SCHEMBL9286288

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

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
FAAH O00519 7/20 0.35
NMT2 O60551 4/20 0.35
NMT1 P30419 4/20 0.35
KDM4E B2RXH2 2/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
GAA P10253 1/20 0.34
RAB9A P51151 2/20 0.34
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL18524096 0.88 ADRB2 (0.39) KDM4EADRB2ADRB1ADRB3MEN1
SCHEMBL6128441 0.85 FAAH (0.38) FAAHTSHRNPC1KMT2A
SCHEMBL9290150 0.84 FAAH (0.36) FAAHTSHRRECQLKMT2A
SCHEMBL16299348 0.82 FAAH (0.36) POLBFAAHTSHRMEN1NPC1
SCHEMBL16299342 0.80 FAAH (0.34) POLBFAAHKDM4ETSHRKMT2A
SCHEMBL9289915 0.80 LMNA (0.39) FAAHRAB9ATSHRNPC1KMT2A
SCHEMBL9290217 0.79 TSHR (0.38) KDM4EGAATSHRMEN1KMT2A
SCHEMBL9289334 0.79 FAAH (0.35) POLBFAAHNPC1KMT2A
SCHEMBL18602758 0.78 FAAH (0.39) FAAHTSHRNPC1KMT2A
SCHEMBL6128438 0.78 FAAH (0.37) FAAHGAATSHRNPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170044160-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2017-02-16 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
WO-2010129057-A2 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. (US) 2010-11-11 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 (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-20170044160-A1 TETRACYCLINE COMPOUNDS TUBB, TUBA1C, TUBA1A POLB 3278/4885FAAH 4449/4885NMT2 830/4885
US-20120135968-A1 Tetracycline Compounds TUBB, TUBA1C, TUBA1A POLB 3278/4885FAAH 4449/4885NMT2 830/4885

“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.