SCHEMBL875911

SCHEMBL875911

CCOC(=O)c1cnc(Oc2cccc(C(F)(F)F)c2)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.54
KDM4E B2RXH2 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 1/20 0.51
SCN9A Q15858 1/20 0.49
LMNA P02545 1/20 0.47
PTGER4 P35408 1/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAOB P27338 1/20 0.47
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
P2RY12 Q9H244 1/20 0.45
P2RY1 P47900 1/20 0.45
P2RX3 P56373 1/20 0.45
LIPE Q05469 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45

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
SCHEMBL15096440 0.86 L3MBTL1 (0.54) SCN9ACYP1A2CYP2C9CYP2C19MAOB
SCHEMBL28633268 0.79 KDM4E (0.56) KDM4ESMN1; SMN2HTTPTGER4CYP1A2
SCHEMBL14831712 0.79 ALDH1A1 (0.44) KDM4ESCN9ACYP2C9CYP2C19MAOB
SCHEMBL17684268 0.78 P2RX3 (0.52) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL7375948 0.78 KDM4E (0.57) KDM4ESMN1; SMN2HTTCYP1A2CYP2C9
SCHEMBL10036988 0.77 KDM4E (0.54) RAB9AKDM4ESMN1; SMN2HTTPTGER4
SCHEMBL876550 0.77 RAB9A (0.60) RAB9ASMN1; SMN2SCN9ALMNACYP1A2
SCHEMBL21628567 0.76 MAOB (0.57) RAB9AKDM4ESMN1; SMN2LMNACYP1A2
SCHEMBL10515255 0.76 RAB9A (0.65) RAB9AKDM4ESMN1; SMN2HTTLMNA
SCHEMBL14661909 0.76 P2RY1 (0.55) RAB9ALMNAPTGER4ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140378487-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LTD (GB) 2014-12-25 US disclosed
US-20140378487-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LTD (GB) 2014-12-25 US disclosed
US-8871928-B2 Tricyclic compounds, preparation methods, and their uses GLAXO GROUP LIMITED (GB) 2014-10-28 US disclosed
US-8871928-B2 Tricyclic compounds, preparation methods, and their uses GLAXO GROUP LIMITED (GB) 2014-10-28 US disclosed
EP-2619203-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES Glaxo Group Limited (GB) 2013-07-31 EP disclosed
US-20130178488-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2013-07-11 US disclosed
US-20130178488-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2013-07-11 US disclosed
WO-2012037782-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2012-03-29 WO disclosed
WO-2012037782-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2012-03-29 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-20140378487-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES LIPG, PCSK9, ENPP2 RAB9A 3062/4885KDM4E 4272/4885SMN1; SMN2 4240/4885
US-20130178488-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES LIPG, PCSK9, ENPP2 RAB9A 3062/4885KDM4E 4272/4885SMN1; SMN2 4240/4885

“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.