SCHEMBL900106

SCHEMBL900106

CCc1cc(C2(c3cc(CC)c(O)c(CC)c3)c3ccccc3-c3ccccc32)cc(CC)c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51
GABRA1 P14867 1/20 0.45
GABRB2 P47870 1/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
OPRK1 P41145 1/20 0.43
CYP2D6 P10635 1/20 0.41
PDK2 Q15119 3/20 0.40
POLB P06746 2/20 0.37
AKR1C1 Q04828 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
THRB P10828 1/20 0.36
APEX1 P27695 1/20 0.36
SIRT1 Q96EB6 1/20 0.35
PTPN5 P54829 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
SCHEMBL18382528 0.90 ESR1 (0.58) ESR1ESR2GABRA1GABRB2MEN1
SCHEMBL13080600 0.89 CYP2D6 (0.46) ESR1ESR2GABRA1GABRB2MEN1
SCHEMBL2883963 0.88 ESR1 (0.47) ESR1ESR2GABRA1GABRB2MEN1
SCHEMBL10051848 0.86 ESR1 (0.47) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL2886031 0.85 ESR1 (0.45) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL383087 0.85 ESR1 (0.64) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL29587240 0.85 ESR1 (0.64) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL5679728 0.84 SMN1; SMN2 (0.50) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL29632505 0.84 SMN1; SMN2 (0.50) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL10076748 0.83 ESR1 (0.50) ESR1ESR2MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012042058-A1 IMPACT RESISTANCE MODIFIERS FOR EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2012-04-05 WO disclosed
US-7781540-B2 Resin composition and molded articles thereof OSAKA GAS CO., LTD. (JP) 2010-08-24 US disclosed
US-7772356-B2 Infrared absorption filter OSAKA GAS CO., LTD. (JP) 2010-08-10 US disclosed
US-7645534-B2 Membrane electrode assembly for solid polymer electrolyte fuel cell HONDA MOTOR CO., LTD. (JP) 2010-01-12 US disclosed
US-20090149625-A1 AROMATIC COMPOUND HAVING FLUORENE SKELETON AND POLYARYLENE HAVING SULFONIC ACID GROUP JSR CORPORATION (JP) 2009-06-11 US disclosed
EP-1808461-B1 RESIN COMPOSITION AND MOLDED OBJECT THEREOF TEIJIN CHEMICALS LTD (JP) 2009-03-11 EP disclosed
EP-2011812-A1 AROMATIC COMPOUND HAVING FLUORENE SKELETON AND POLYARYLENE HAVING SULFONIC ACID GROUP JSR Corporation (JP) 2009-01-07 EP disclosed
US-20080085955-A1 Resin Composition And Molded Articles Thereof OSAKA GAS CO., LTD. (JP) 2008-04-10 US disclosed
US-20070293606-A1 Infrared Absorption Filter OSAKA GAS CO., LTD. (JP) 2007-12-20 US disclosed
US-20070248865-A1 Membrane electrode assembly for solid polymer electrolyte fuel cell HONDA MOTOR CO., LTD. 2007-10-25 US disclosed
EP-1808461-A1 RESIN COMPOSITION AND MOLDED OBJECT THEREOF Teijin Chemicals, Ltd. (JP) 2007-07-18 EP disclosed
EP-1804093-A1 INFRARED ABSORBING FILTER OSAKA GAS CO., LTD. (JP) 2007-07-04 EP disclosed
EP-1122746-B1 Composition for film formation and insulating film JSR CORP (JP) 2004-09-22 EP disclosed
EP-1122746-A1 Composition for film formation and insulating film JSR Corporation (JP) 2001-08-08 EP disclosed
US-5520809-A MIXTURE OF POLYMERS, FLUORENE SKELETON, GAS SEPARATION, FOOD AND DRUG APPLICATIONS NIPPON STEEL CORPORATION (JP) 1996-05-28 US disclosed
US-5049169-A Oxygen, nitrogen selectivity NIPPON STEEL CORPORATION (JP) 1991-09-17 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-20090149625-A1 AROMATIC COMPOUND HAVING FLUORENE SKELETON AND POLYARYLENE HAVING SULFONIC ACID GROUP AFF2, FGFR1, FUS ESR1 843/4885ESR2 992/4885GABRA1 987/4885

“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.