SCHEMBL5915166

SCHEMBL5915166

CCCCCCSc1nc(Cc2ccccn2)n[nH]1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.43
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
XDH P47989 1/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36

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
SCHEMBL5915225 0.79 GPR84 (0.40) GPR84NPC1RAB9AXDHLMNA
SCHEMBL10514376 0.78 KDM4E (0.50) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL4197676 0.77 RAB9A (0.49) NPC1RAB9AXDHSMN1; SMN2KDM4E
SCHEMBL4192105 0.76 CYP1A2 (0.41) GPR84NPC1RAB9AXDHMAPT
SCHEMBL5915139 0.75 GPR84 (0.39) GPR84NPC1RAB9AXDHLMNA
SCHEMBL5915134 0.75 GPR84 (0.41) GPR84LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL26113985 0.74 SMN1; SMN2 (0.47) GPR84XDHLMNAMAPTSMN1; SMN2
SCHEMBL5915172 0.73 ALDH1A1 (0.38) GPR84LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL5915150 0.73 NPC1 (0.48) NPC1RAB9ALMNASMN1; SMN2HPGD
SCHEMBL5915136 0.73 CYP1A2 (0.51) GPR84NPC1RAB9AMAPT

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-20060247280-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2006-11-02 US claimed
US-20060247280-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2006-11-02 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-20060247280-A1 Compounds and methods METAP2, DNPEP, METAP1 GPR84 1358/4885NPC1 3549/4885RAB9A 1333/4885

“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.