SCHEMBL1346956

SCHEMBL1346956

CC1C(c2ccc(O)cc2)Cc2ccc(O)cc2C1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.45
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
SOAT1 P35610 1/20 0.37
CYP19A1 P11511 3/20 0.37
SIGMAR1 Q99720 1/20 0.37
DRD1 P21728 1/20 0.36

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
SCHEMBL1344609 0.88 SHBG (0.43) SHBGESR1ESR2SIGMAR1
SCHEMBL1346531 0.88 SHBG (0.43) SHBGESR1ESR2SIGMAR1
SCHEMBL1346151 0.88 SHBG (0.43) SHBGESR1ESR2SIGMAR1
SCHEMBL1346542 0.87 SHBG (0.44) SHBGESR1ESR2SIGMAR1
SCHEMBL1346118 0.87 SHBG (0.44) SHBGESR1ESR2SIGMAR1
SCHEMBL1346439 0.87 SHBG (0.44) SHBGESR1ESR2SIGMAR1
SCHEMBL1346006 0.86 SHBG (0.47) SHBGESR1ESR2SOAT1SIGMAR1
SCHEMBL1347419 0.83 SHBG (0.42) SHBGESR1ESR2SOAT1SIGMAR1
SCHEMBL1346403 0.83 SHBG (0.44) SHBGESR1ESR2SOAT1SIGMAR1
SCHEMBL1346297 0.83 SHBG (0.42) SHBGESR1ESR2SOAT1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2406206-B1 TETRAHYDRONAPHTHALEN-2-OL DERIVATIVES MSD OSS BV (NL) 2013-01-30 EP disclosed
US-8063102-B2 Tetrahydronaphthalen-2-ol derivatives N.V. ORGANON (NL) 2011-11-22 US disclosed
US-8063102-B2 Tetrahydronaphthalen-2-ol derivatives N.V. ORGANON (NL) 2011-11-22 US disclosed
US-8063102-B2 Tetrahydronaphthalen-2-ol derivatives N.V. ORGANON (NL) 2011-11-22 US disclosed
US-20100240748-A1 TETRAHYDRONAPHTHALEN-2-OL DERIVATIVES N. V. ORGANON 2010-09-23 US disclosed
US-20100240748-A1 TETRAHYDRONAPHTHALEN-2-OL DERIVATIVES N. V. ORGANON 2010-09-23 US disclosed
US-20100240748-A1 TETRAHYDRONAPHTHALEN-2-OL DERIVATIVES N. V. ORGANON 2010-09-23 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-20100240748-A1 TETRAHYDRONAPHTHALEN-2-OL DERIVATIVES VHL, BRCA1, TPH2 SHBG 31/4885ESR1 183/4885ESR2 20/4885

“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.