SCHEMBL8404699

SCHEMBL8404699

CCCCCc1ncsc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.44
KDM4E B2RXH2 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
HSD11B1 P28845 2/20 0.41
GCGR P47871 2/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
STAT1 P42224 1/20 0.38
RAB9A P51151 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KCNH2 Q12809 1/20 0.36
TSHR P16473 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 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
SCHEMBL6135190 0.87 CYP2D6 (0.44) DHFRKDM4EMAPTSMN1; SMN2NPC1
SCHEMBL8403092 0.74 GPR84 (0.49) DHFRGPR84HSD11B1MAPTTP53
SCHEMBL2301659 0.74 KDM4E (0.53) KDM4EALDH1A1L3MBTL1
SCHEMBL4652489 0.74 KDM4E (0.49) KDM4EMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL4652481 0.74 KDM4E (0.49) KDM4EMAPTALDH1A1
SCHEMBL27744669 0.73 DHFR (0.47) DHFRKDM4EGPR84HSD11B1GCGR
SCHEMBL27629514 0.73 ALOX5 (0.50) DHFRKDM4EGPR84HSD11B1GCGR
SCHEMBL24023174 0.70 KCNH2 (0.37) DHFRKDM4ETP53ALDH1A1TDP1
SCHEMBL6135328 0.70 MAPT (0.54) GPR84MAPTKCNH2
SCHEMBL15068264 0.69 GPR84 (0.63) DHFRGPR84HSD11B1GCGRTDP1

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-7763607-B2 Pharmaceutical compositions comprising CBx cannabinoid receptor modulators and potassium channel modulators SOLVAY PHARMACEUTICALS GMBH (DE) 2010-07-27 US disclosed
US-20070254862-A1 Pharmaceutical compositions comprising CBx cannabinoid receptor modulators and potassium channel modulators SOLVAY PHARMACEUTICALS GMBH (DE) 2007-11-01 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-20070254862-A1 Pharmaceutical compositions comprising CBx cannabinoid receptor modulators and potassium channel modulators CNR1, CNR2, KCNJ11 DHFR 3229/4885KDM4E 782/4885GPR84 308/4885

“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.