SCHEMBL8938834

SCHEMBL8938834

Cc1cc(Cl)cc(CN2CCC(Oc3cc4c(C)c[nH]c(=O)c4cc3C)CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.41
CCR3 P51677 5/20 0.41
KCNH2 Q12809 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAOA P21397 3/20 0.39
MAOB P27338 3/20 0.39
SCN8A Q9UQD0 3/20 0.38
SCN1A P35498 2/20 0.38
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35

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
SCHEMBL8935610 0.95 HRH1 (0.43) HRH1CCR3KCNH2MAOAMAOB
SCHEMBL8935590 0.89 MAOB (0.49) HRH1CCR3KCNH2MAOAMAOB
SCHEMBL8938841 0.88 OPRM1 (0.43) HRH1CCR3KCNH2MAOAMAOB
SCHEMBL8935571 0.88 MAOA (0.52) HRH1CCR3KCNH2MAOAMAOB
SCHEMBL8935605 0.86 MAOA (0.48) MAOAMAOBSCN8ASCN1ADRD2
SCHEMBL8938789 0.86 ROCK1 (0.51) HRH1CCR3KCNH2MEN1KMT2A
SCHEMBL8939144 0.85 ROCK1 (0.52) HRH1CCR3MEN1KMT2AMAOA
SCHEMBL8939080 0.83 HRH1 (0.39) HRH1CCR3KCNH2MEN1KMT2A
SCHEMBL8938967 0.83 HRH1 (0.44) HRH1CCR3KCNH2MEN1KMT2A
SCHEMBL8935595 0.82 HRH1 (0.46) HRH1CCR3KCNH2MEN1KMT2A

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-8188117-B2 Piperidinyl-substituted isoquinolone derivatives SANOFI-AVENTIS (FR) 2012-05-29 US disclosed
US-20090093518-A1 Piperidinyl-substituted isoquinolone derivatives SANOFI-AVENTIS (FR) 2009-04-09 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-20090093518-A1 Piperidinyl-substituted isoquinolone derivatives MYLK2, MYLK, RHOT2 HRH1 2936/4885CCR3 3890/4885KCNH2 2400/4885

“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.