SCHEMBL2955962

SCHEMBL2955962

COc1ccc(CNc2cccc(-c3nn(C)cc3Br)c2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
L3MBTL1 Q9Y468 3/20 0.48
GAA P10253 4/20 0.47
POLB P06746 2/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
PDE4B Q07343 2/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
KIT P10721 1/20 0.43
FLT3 P36888 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL4859619 0.85 SMN1; SMN2 (0.56) MAPTKMT2AMEN1L3MBTL1GAA
SCHEMBL2961042 0.81 L3MBTL1 (0.44) MAPTKMT2AMEN1L3MBTL1POLB
SCHEMBL2955961 0.79 L3MBTL1 (0.39) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL6479318 0.79 L3MBTL1 (0.48) MAPTL3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL10119743 0.76 MAPT (0.71) MAPTKMT2AMEN1L3MBTL1GAA
SCHEMBL6490218 0.75 L3MBTL1 (0.54) MAPTL3MBTL1POLBRAB9AALDH1A1
SCHEMBL8186162 0.74 TSHR (0.42) MAPTKMT2AMEN1L3MBTL1GAA
SCHEMBL2958471 0.73 L3MBTL1 (0.62) MAPTKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL2949934 0.73 NPC1 (0.60) MAPTKMT2AMEN1L3MBTL1POLB
SCHEMBL2958211 0.73 L3MBTL1 (0.44) MAPTL3MBTL1GAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754866-B2 Non-endogenous, constitutively activated human serotonin receptors and small molecule modulators thereof ARENA PHARMACEUTICALS, INC. (US) 2010-07-13 US disclosed
US-20090076254-A1 NON-ENDOGENOUS, CONSTITUTIVELY ACTIVATED HUMAN SEROTONIN RECEPTORS AND SMALL MOLECULE MODULATORS THEREOF ARENA PHARMACEUTICALS INC. 2009-03-19 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-20090076254-A1 NON-ENDOGENOUS, CONSTITUTIVELY ACTIVATED HUMAN SEROTONIN RECEPTORS AND SMALL MOLECULE MODULATORS THEREOF HTR2A, HTR3B, HTR3A MAPT 4649/4885KMT2A 2468/4885MEN1 4559/4885

“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.