SCHEMBL12839673

SCHEMBL12839673

CC(C)Cc1nc(-c2ccc(N)cc2)cnc1NC(=O)CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
GHSR Q92847 1/20 0.41
ROCK2 O75116 1/20 0.41
WNT1 P04628 1/20 0.41
GSK3B P49841 1/20 0.41
DYRK1A Q13627 1/20 0.41
HCAR2 Q8TDS4 2/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2C9 P11712 1/20 0.40
LDHA P00338 1/20 0.39
LDHB P07195 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 2/20 0.39
MCHR1 Q99705 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL12839674 0.94 SMN1; SMN2 (0.43) RAB9ALMNAGAAALDH1A1NPC1
SCHEMBL13067820 0.90 HCAR2 (0.44) RAB9AROCK2WNT1GSK3BDYRK1A
SCHEMBL12839675 0.90 TMIGD3 (0.43) RAB9AGHSRWNT1GSK3BDYRK1A
SCHEMBL12839243 0.89 ROCK2 (0.45) RAB9AGHSRROCK2WNT1GSK3B
SCHEMBL12839026 0.88 MCHR1 (0.47) RAB9AGHSRROCK2WNT1GSK3B
SCHEMBL12839207 0.88 ROCK2 (0.44) RAB9AGHSRROCK2WNT1GSK3B
SCHEMBL12840355 0.87 SMN1; SMN2 (0.47) RAB9ALMNAMAPTGAAALDH1A1
SCHEMBL12838483 0.85 TRPV1 (0.49) RAB9AHCAR2CYP2C8CYP2C9LMNA
SCHEMBL12839258 0.85 ADORA1 (0.46) RAB9AGHSRLDHALDHBMAPT
SCHEMBL12840035 0.84 LMNA (0.44) RAB9ALMNAGAAALDH1A1NPC1

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-20110070656-A1 Fluorescent Proteins JNC CORPORATION (JP) 2011-03-24 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-20110070656-A1 Fluorescent Proteins CACYBP, CHLSN, LCP2 RAB9A 2980/4885GHSR 3750/4885ROCK2 4744/4885

“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.