SCHEMBL8825950

SCHEMBL8825950

C1CC[C@@H]2CCCNC2C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 3/20 0.44
L3MBTL3 Q96JM7 2/20 0.44
EPAS1 Q99814 1/20 0.42
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL13612540 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL242797 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL26722446 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL12699779 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL4189941 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL90804 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL13447 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL166482 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL14621027 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL937629 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9446021-B2 Derivatives of fluorene, anthracene, xanthene, dibenzosuberone and acridine and uses thereof DOGWOOD PHARMACEUTICALS, INC. (US) 2016-09-20 US disclosed
US-20150313873-A1 Derivatives of Fluorene, Anthracene, Xanthene, Dibenzosuberone and Acridine and Uses Thereof DOGWOOD PHARMACEUTICALS, INC. 2015-11-05 US disclosed
US-9120754-B2 Derivatives of fluorene, anthracene, xanthene, dibenzosuberone and acridine and uses thereof DOGWOOD PHARMACEUTICALS, INC. (US) 2015-09-01 US disclosed
US-20120129837-A1 Derivatives of Fluorene, Anthracene, Xanthene, Dibenzosuberone and Acridine and Uses Thereof ALLERGAN SALES, LLC 2012-05-24 US disclosed
US-7786217-B2 formed by contacting an end functionalized polyolefins with living organometallic polymers in the presence of an initiator, to form block polymers having heat and oxidation reistance, used as medical equipment UNIVERSITY OF MASSACHUSETTS LOWELL (US) 2010-08-31 US disclosed
US-20080255330-A1 Organometallic-Polyisomonoolefin Block Copolymers UNIVERSITY OF MASSACHUSETTS LOWELL 2008-10-16 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 (2 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-20120129837-A1 Derivatives of Fluorene, Anthracene, Xanthene, Dibenzosuberone and Acridine and Uses Thereof WNT1, CTNND1, CTNNB1 MBTD1 1901/4885L3MBTL3 4398/4885EPAS1 3892/4885
US-20150313873-A1 Derivatives of Fluorene, Anthracene, Xanthene, Dibenzosuberone and Acridine and Uses Thereof WNT1, CTNND1, CTNNB1 MBTD1 1901/4885L3MBTL3 4398/4885EPAS1 3892/4885

“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.