SCHEMBL18525115

SCHEMBL18525115

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

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.37
MAPT P10636 3/20 0.37
ALOX5 P09917 3/20 0.35
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 3/20 0.35
CYP1A2 P05177 3/20 0.35
CYP2C19 P33261 3/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP2C9 P11712 2/20 0.34
TSHR P16473 1/20 0.34
PTGES O14684 2/20 0.34
NPC1 O15118 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 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
SCHEMBL16299399 0.91 FAAH (0.36) FAAHMAPTALOX5PPARGPPARA
SCHEMBL18525121 0.88 FAAH (0.37) FAAHMAPTALOX5PPARGPPARA
SCHEMBL16299327 0.88 FAAH (0.37) FAAHMAPTALOX5PPARGPPARA
SCHEMBL18525117 0.87 PTPN1 (0.40) THRATHRBKMT2ALMNATSHR
SCHEMBL9286581 0.82 MAPT (0.38) FAAHMAPTALOX5PPARGPPARA
SCHEMBL9289257 0.82 MAPT (0.38) FAAHMAPTALOX5PPARGPPARA
SCHEMBL16299401 0.81 FAAH (0.36) FAAHMAPTALOX5PPARGPPARA
SCHEMBL16299335 0.81 FAAH (0.36) FAAHMAPTALOX5PPARGPPARA
SCHEMBL10262710 0.80 FAAH (0.37) FAAHMAPTALOX5PPARGPPARA
SCHEMBL9289254 0.80 FAAH (0.37) FAAHMAPTALOX5PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170044160-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2017-02-16 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-20170044160-A1 TETRACYCLINE COMPOUNDS TUBB, TUBA1C, TUBA1A FAAH 4449/4885MAPT 103/4885ALOX5 4070/4885

“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.