SCHEMBL3639848

SCHEMBL3639848

FC(F)(F)c1ccc(-c2n[nH]cc2CNc2cc(Cl)ccc2Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.38
P2RX1 P51575 1/20 0.38
MCL1 Q07820 1/20 0.37
CNR1 P21554 4/20 0.36
IDO1 P14902 3/20 0.36
TDO2 P48775 3/20 0.36
DPP4 P27487 1/20 0.36
DHFR P00374 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
ADRA2A P08913 1/20 0.34

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
SCHEMBL3635919 0.91 KDM4E (0.41) P2RX1CNR1IDO1TDO2DPP4
SCHEMBL3639433 0.86 ERBB2 (0.45) IDO1TDO2KDM4EL3MBTL1MEN1
SCHEMBL3636650 0.83 ERBB2 (0.43) P2RX1MEN1KMT2A
SCHEMBL3635158 0.82 MAPT (0.44) L3MBTL1MEN1ALDH1A1KMT2A
SCHEMBL3639603 0.82 P2RX1 (0.42) P2RX1L3MBTL1ALDH1A1CYP1A2CYP2C19
SCHEMBL3641227 0.81 ERBB2 (0.47) P2RX1KDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL3636134 0.81 P2RX7 (0.40) IDO1TDO2KDM4EL3MBTL1
SCHEMBL3640997 0.79 CSF1R (0.43) MEN1ALDH1A1CYP3A4CYP2D6CYP2C19
SCHEMBL3641215 0.79 MAPT (0.44) CYP3A4CYP2C19
SCHEMBL3637523 0.78 CLK1 (0.41) P2RX1CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242933-B2 Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2 (mGlu2 receptor) AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-26 US disclosed
CN-101687790-B Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2(MGLU2 receptor) ABBVIE INC 2015-02-11 CN disclosed
EP-2167464-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) Abbott GmbH & Co. KG (DE) 2010-03-31 EP disclosed
WO-2008145616-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) ABBOTT GMBH & CO. KG (DE) 2008-12-04 WO disclosed
US-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2008-12-04 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-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) GRM2, GRIN2C, GRM1 CHRNA7 125/4885P2RX1 169/4885MCL1 4556/4885

“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.