SCHEMBL274568

SCHEMBL274568

CC1(c2ccccc2)NCCc2c1[nH]c1ccccc21

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 12/20 0.60
OGFRL1 Q5TC84 8/20 0.60
OPRL1 P41146 6/20 0.60
LMNA P02545 2/20 0.55
OPRD1 P41143 2/20 0.46
OPRK1 P41145 2/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.44
TSHR P16473 1/20 0.44
CRHBP P24387 1/20 0.44
MAPK1 P28482 1/20 0.44
CRHR2 Q13324 1/20 0.44
SSTR3 P32745 1/20 0.43
KCNH2 Q12809 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL998772 0.86 OPRM1 (0.53) OPRM1OGFRL1OPRL1LMNAOPRD1
SCHEMBL12592476 0.81 LMNA (0.60) OPRM1OGFRL1OPRL1LMNAKMT2A
SCHEMBL14471060 0.79 LMNA (0.57) OPRM1OGFRL1OPRL1LMNAKMT2A
SCHEMBL9480993 0.77 LMNA (0.52) OPRM1OGFRL1OPRL1LMNAKMT2A
SCHEMBL10038853 0.75 OPRM1 (1.00) OPRM1OGFRL1OPRL1LMNAOPRD1
SCHEMBL517133 0.75 OPRM1 (1.00) OPRM1OGFRL1OPRL1LMNAOPRD1
Hydrochloric Acid SCHEMBL8820315 0.74 LMNA (0.46) OPRM1OGFRL1OPRL1LMNAKMT2A
Hydrochloric Acid SCHEMBL1303569 0.74 OPRM1 (1.00) OPRM1OGFRL1OPRL1LMNAOPRD1
SCHEMBL17807190 0.74 OPRM1 (0.69) OPRM1OGFRL1OPRL1LMNAOPRD1
SCHEMBL10051500 0.73 LMNA (0.69) OPRM1OGFRL1OPRL1LMNAKMT2A

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3109385-A None JP disclosed
US-11613538-B2 Method of inhibiting or reducing a viral infection PTC THERAPEUTICS, INC. (US) 2023-03-28 US disclosed
US-8133992-B2 Azepinoindole and pyridoindole derivatives as pharmaceutical agents EXELIXIS, INC. (US) 2012-03-13 US disclosed
EP-1532153-B1 AZEPINOINDOLE AND PYRIDOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS X CEPTOR THERAPEUTICS INC (US) 2012-02-29 EP disclosed
US-20090326218-A1 Azepinoindole and Pyridoindole Derivatives as Pharmaceutical Agents EXELIXIS, INC. (US) 2009-12-31 US disclosed
US-7485634-B2 Azepinoindole and pyridoindole derivatives as pharmaceutical agents EXELIXIS, INC. (US) 2009-02-03 US disclosed
EP-1532153-A1 AZEPINOINDOLE AND PYRIDOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS X-Ceptor Therapeutics, Inc. (US) 2005-05-25 EP disclosed
US-20040023947-A1 Azepinoindole and pyridoindole derivatives as pharmaceutical agents X-CEPTOR THERAPEUTICS INC. 2004-02-05 US disclosed
WO-2003099821-A1 AZEPINOINDOLE AND PYRIDOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS X-CEPTOR THERAPEUTICS, INC. (US) 2003-12-04 WO disclosed
JP-H03109385-A NEW TRICYCLIC AMINE COMPOUND AND SALT THEREOF FUJISAWA PHARMACEUT CO LTD 1991-05-09 JP 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 (3 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-20040023947-A1 Azepinoindole and pyridoindole derivatives as pharmaceutical agents HTR5A, MTNR1A, PTGDR OPRM1 140/4885OGFRL1 773/4885OPRL1 115/4885
US-11613538-B2 Method of inhibiting or reducing a viral infection SARS1, EIF2AK2, POLRMT OPRM1 3341/4885OGFRL1 1883/4885OPRL1 3627/4885
US-20090326218-A1 Azepinoindole and Pyridoindole Derivatives as Pharmaceutical Agents HTR5A, MTNR1A, PTGDR OPRM1 140/4885OGFRL1 773/4885OPRL1 115/4885

“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.