SCHEMBL3107655

SCHEMBL3107655

CCc1nnn(-c2cccc(Cl)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.47
PKM P14618 1/20 0.46
MEN1 O00255 2/20 0.44
GAA P10253 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NOTUM Q6P988 2/20 0.44
HPGD P15428 1/20 0.42

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
SCHEMBL2895891 0.86 NOTUM (0.54) GRM5PKMMEN1GAAKMT2A
SCHEMBL2895023 0.84 GRM5 (0.44) GRM5PKMMEN1GAAKMT2A
SCHEMBL5739257 0.82 GRM5 (0.42) GRM5PKMMEN1GAAKMT2A
SCHEMBL2897304 0.82 NOTUM (0.50) GRM5PKMMEN1GAAKMT2A
SCHEMBL3955492 0.82 GRM5 (0.42) GRM5PKMMEN1GAAKMT2A
SCHEMBL5740467 0.81 DRD4 (0.41) GAAALDH1A1LMNA
SCHEMBL13892315 0.80 KDM4E (0.49) GRM5PKMMEN1KMT2ANPC1
SCHEMBL13892294 0.80 NOTUM (0.48) GRM5KMT2ANPC1ALDH1A1LMNA
SCHEMBL4407303 0.80 HPGD (0.57) GRM5PKMNPC1ALDH1A1LMNA
SCHEMBL2895781 0.79 PKM (0.39) GRM5PKMMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 ASTRAZENECA AB (SE) 2010-10-28 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-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 GRM5, GRM3, GRIK5 GRM5 1/4885PKM 2640/4885MEN1 4431/4885

“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.