SCHEMBL998772

SCHEMBL998772

CC1(c2cccc(F)c2)NCCc2c1[nH]c1ccccc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 11/20 0.53
OGFRL1 Q5TC84 8/20 0.53
OPRL1 P41146 5/20 0.49
LMNA P02545 3/20 0.47
CFTR P13569 1/20 0.47
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
SSTR3 P32745 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAPT P10636 2/20 0.40
PAX8 Q06710 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
TSHR P16473 1/20 0.39
CRHBP P24387 1/20 0.39
MAPK1 P28482 1/20 0.39
CRHR2 Q13324 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
SCHEMBL274568 0.86 OPRM1 (0.60) OPRM1OGFRL1OPRL1LMNAKMT2A
SCHEMBL998070 0.84 CFTR (0.52) OPRM1OGFRL1CFTR
SCHEMBL6031806 0.84 OPRM1 (0.53) OPRM1OGFRL1OPRL1LMNACFTR
SCHEMBL517410 0.79 OPRM1 (0.78) OPRM1OGFRL1OPRL1LMNACFTR
SCHEMBL10038873 0.79 OPRM1 (0.78) OPRM1OGFRL1OPRL1LMNACFTR
SCHEMBL10038858 0.79 OPRM1 (0.78) OPRM1OGFRL1OPRL1LMNACFTR
SCHEMBL2435467 0.77 OPRM1 (0.56) OPRM1OGFRL1OPRL1LMNACFTR
SCHEMBL2438888 0.75 OPRM1 (0.59) OPRM1OGFRL1OPRL1CFTROPRD1
SCHEMBL2437691 0.74 OPRM1 (0.61) OPRM1OGFRL1OPRL1CFTROPRD1
SCHEMBL2434962 0.74 OPRM1 (0.56) OPRM1OGFRL1OPRL1LMNACFTR

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-1637521-B1 NOVEL TRICYCLIC HETEROCYCLE COMPOUND ONO PHARMACEUTICAL CO (JP) 2013-06-19 EP disclosed
US-7872133-B2 Tricyclic heterocycle compound ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-18 US disclosed
US-20060154944-A1 Novel tricyclic heterocycle compound ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-13 US disclosed
EP-1637521-A1 NOVEL TRICYCLIC HETEROCYCLE COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-03-22 EP 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-20060154944-A1 Novel tricyclic heterocycle compound CYP11B1, CYP11B2, HCCS OPRM1 1743/4885OGFRL1 2821/4885OPRL1 1785/4885

“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.