SCHEMBL3634838

SCHEMBL3634838

CCCn1c(-c2ccc(Nc3ccc(Cl)cc3)nn2)nc2cccc(Cl)c21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.49
MAPT P10636 5/20 0.47
S1PR1 P21453 1/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
AKT1 P31749 1/20 0.36
KDR P35968 1/20 0.36
PTK2 Q05397 1/20 0.36
GSK3B P49841 1/20 0.35
TP53 P04637 2/20 0.34
GAA P10253 1/20 0.34
PRMT5 O14744 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CRHR1 P34998 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
SCHEMBL3633414 0.90 GRM5 (0.47) GRM5MAPTLMNAMAPK1KDM4E
SCHEMBL3635491 0.88 GRM5 (0.65) GRM5MAPTS1PR1LMNAKDM4E
SCHEMBL3633636 0.85 MAPT (0.63) GRM5MAPTLMNAMAPK1KDM4E
SCHEMBL3629201 0.82 GRM5 (0.60) GRM5MAPTS1PR1
SCHEMBL3635985 0.82 GRM5 (0.59) GRM5MAPTS1PR1LMNAKDM4E
SCHEMBL3629788 0.81 GRM5 (0.47) GRM5MAPTS1PR1LMNAKDM4E
SCHEMBL3634834 0.79 GRM5 (0.45) GRM5MAPTS1PR1LMNAKDM4E
SCHEMBL3632235 0.78 GRM5 (0.62) GRM5MAPTS1PR1AKT1KDR
SCHEMBL3633677 0.77 GRM5 (0.61) GRM5MAPTS1PR1LMNAKDM4E
SCHEMBL3637528 0.76 GRM5 (0.60) GRM5MAPTLMNAKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146969-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 Novartis Ag (CH) 2010-01-27 EP disclosed
US-20090105266-A1 Organic compounds NOVARTIS AG (CH) 2009-04-23 US disclosed
WO-2008128968-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 NOVARTIS AG (CH) 2008-10-30 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 (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-20090105266-A1 Organic compounds SLCO2B1, SLCO1B1, SLCO1B3 GRM5 4545/4885MAPT 995/4885S1PR1 3425/4885

“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.