SCHEMBL6634840

SCHEMBL6634840

O=C(NCCc1cccs1)c1cc2scc(Cl)c2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.56
RAB9A P51151 7/20 0.56
LMNA P02545 1/20 0.56
TAAR1 Q96RJ0 2/20 0.53
SMN1; SMN2 Q16637 5/20 0.51
PYGL P06737 1/20 0.48
BRD4 O60885 1/20 0.45
CYP1A2 P05177 2/20 0.43
MAPK14 Q16539 1/20 0.42
IL1B P01584 1/20 0.42
P2RX7 Q99572 1/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
ADAM17 P78536 1/20 0.41
GPR84 Q9NQS5 1/20 0.41
HTT P42858 2/20 0.41
CYP2D6 P10635 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
PSMD14 O00487 1/20 0.40

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
SCHEMBL6630739 0.83 PYGL (0.53) NPC1RAB9ALMNATAAR1SMN1; SMN2
SCHEMBL6631318 0.80 NPC1 (0.53) NPC1RAB9ALMNATAAR1SMN1; SMN2
SCHEMBL6629024 0.80 PYGL (0.48) NPC1RAB9ASMN1; SMN2PYGLMAPT
SCHEMBL6630450 0.78 MTNR1A (0.49) NPC1RAB9ASMN1; SMN2PYGLMAPT
SCHEMBL6631404 0.76 NPC1 (0.53) NPC1RAB9ALMNASMN1; SMN2PYGL
SCHEMBL6630734 0.76 PYGL (0.54) NPC1RAB9APYGLMAPTGPR84
SCHEMBL6631163 0.74 PYGL (0.54) LMNASMN1; SMN2PYGLCYP1A2MAPT
SCHEMBL30175948 0.74 KDM4E (0.61) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6629471 0.73 PYGL (0.55) NPC1RAB9ALMNASMN1; SMN2PYGL
SCHEMBL2606804 0.73 NPC1 (0.50) NPC1RAB9ALMNATAAR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1317459-B1 BICYCLIC PYRROLYL AMIDES AS GLUCOGEN PHOSPHORYLASE INHIBITORS ASTRAZENECA AB (SE) 2004-04-07 EP claimed
US-20030232875-A1 Bicyclic pyrrolyl amides as glucogen phosphorylase inhibitors ASTRAZENECA AB (SE) 2003-12-18 US claimed
EP-1317459-B1 BICYCLIC PYRROLYL AMIDES AS GLUCOGEN PHOSPHORYLASE INHIBITORS ASTRAZENECA AB (SE) 2004-04-07 EP disclosed
US-20030232875-A1 Bicyclic pyrrolyl amides as glucogen phosphorylase inhibitors ASTRAZENECA AB (SE) 2003-12-18 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-20030232875-A1 Bicyclic pyrrolyl amides as glucogen phosphorylase inhibitors GYS1, GYS2, PYGL NPC1 3131/4885RAB9A 3130/4885LMNA 3115/4885

“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.