SCHEMBL2297807

SCHEMBL2297807

Fc1cccc(-c2ccc(B3OB(c4ccc(-c5cccc(F)c5)cc4F)OB(c4ccc(-c5cccc(F)c5)cc4F)O3)c(F)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.47
ESR2 Q92731 1/20 0.47
CYP11B2 P19099 2/20 0.42
CYP17A1 P05093 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP11B1 P15538 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
NOTUM Q6P988 1/20 0.38
PTPN1 P18031 1/20 0.37
MAP4K4 O95819 1/20 0.36
PGR P06401 4/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
DCLRE1B Q9H816 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
NR4A1 P22736 1/20 0.35
NR4A2 P43354 1/20 0.35

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
SCHEMBL10269895 0.85 TAAR1 (0.43) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL258030 0.83 TAAR1 (0.42) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL10269575 0.82 LIPG (0.45) TAAR1ESR2CYP11B2TNKS2PGR
SCHEMBL7860065 0.78 ALDH1A1 (0.41) CA9PDE3A
SCHEMBL10269560 0.75 ESR2 (0.38) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL19665085 0.74 TAAR1 (0.59) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL31147883 0.74 TAAR1 (0.59) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL30068301 0.74 TAAR1 (0.59) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL20898196 0.73 TAAR1 (0.53) TAAR1ESR2CYP11B2CYP17A1CYP3A4
SCHEMBL31067161 0.73 TAAR1 (0.53) TAAR1ESR2CYP11B2CYP17A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180244700-A1 METHODS OF TREATING A FATTY ACID AMIDE HYDROLASE-MEDIATED CONDITION INFINITY PHARMACEUTICALS, INC. 2018-08-30 US disclosed
US-9951089-B2 Methods of treating a fatty acid amide hydrolase-mediated condition INFINITY PHARMACEUTICALS, INC. (US) 2018-04-24 US disclosed
US-9951089-B2 Methods of treating a fatty acid amide hydrolase-mediated condition INFINITY PHARMACEUTICALS, INC. (US) 2018-04-24 US disclosed
US-9951089-B2 Methods of treating a fatty acid amide hydrolase-mediated condition INFINITY PHARMACEUTICALS, INC. (US) 2018-04-24 US disclosed
US-20150239912-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. 2015-08-27 US disclosed
US-20150239912-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. 2015-08-27 US disclosed
US-20150239912-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. 2015-08-27 US disclosed
US-9034849-B2 Fatty acid amide hydrolase inhibitors INFINITY PHARMACEUTICALS, INC. (US) 2015-05-19 US disclosed
US-9034849-B2 Fatty acid amide hydrolase inhibitors INFINITY PHARMACEUTICALS, INC. (US) 2015-05-19 US disclosed
US-9034849-B2 Fatty acid amide hydrolase inhibitors INFINITY PHARMACEUTICALS, INC. (US) 2015-05-19 US disclosed
EP-2531511-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS Infinity Pharmaceuticals, Inc. (US) 2012-12-12 EP disclosed
US-20110201574-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. 2011-08-18 US disclosed
US-20110201574-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. 2011-08-18 US disclosed
US-20110201574-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. 2011-08-18 US disclosed
WO-2011097233-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. (US) 2011-08-11 WO disclosed
WO-2011097233-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS INFINITY PHARMACEUTICALS, INC. (US) 2011-08-11 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 (3 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-20110201574-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS FAAH, FAAH2, FASN TAAR1 2103/4885ESR2 3039/4885CYP11B2 3327/4885
US-20180244700-A1 METHODS OF TREATING A FATTY ACID AMIDE HYDROLASE-MEDIATED CONDITION FAAH, FAAH2, FASN TAAR1 2133/4885ESR2 2277/4885CYP11B2 2852/4885
US-20150239912-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS FAAH, FAAH2, FASN TAAR1 2103/4885ESR2 3039/4885CYP11B2 3327/4885

“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.