SCHEMBL918007

SCHEMBL918007

CC[C]1CC=Cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 3/20 0.38
TP53 P04637 3/20 0.34
CYP2D6 P10635 4/20 0.33
CYP1A2 P05177 3/20 0.33
DRD3 P35462 3/20 0.33
CHRM2 P08172 2/20 0.33
HTR1A P08908 2/20 0.33
CHRM1 P11229 2/20 0.33
DRD2 P14416 2/20 0.33
TSHR P16473 2/20 0.33
ADRA2C P18825 2/20 0.33
CHRM3 P20309 2/20 0.33
SLC6A2 P23975 2/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
SLC6A4 P31645 2/20 0.33
ADRA1A P35348 2/20 0.33
HRH1 P35367 2/20 0.33
HTR2B P41595 2/20 0.33
MTOR P42345 2/20 0.33

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
SCHEMBL18243518 0.89 SETD7 (0.36) SETD7TP53CYP2D6CYP1A2DRD3
SCHEMBL18242409 0.85 SETD7 (0.38) SETD7TP53CYP2D6CYP1A2DRD3
SCHEMBL10419982 0.84 SETD7 (0.40) SETD7HTR2AKCNH2PTPN1
SCHEMBL9647956 0.83 SETD7 (0.43) SETD7HTR2AKCNH2PTPN1
SCHEMBL10760571 0.83 SETD7 (0.43) SETD7HTR2AKCNH2PTPN1
SCHEMBL6668478 0.78 CALM1 (0.41) CYP2D6CYP1A2TSHRADRA2CADRA1A
SCHEMBL4787417 0.76 GABRA1 (0.34) TP53CYP2D6CYP1A2DRD3CHRM2
SCHEMBL4313202 0.76 ALDH1A1 (0.37) TP53CYP1A2ALDH1A1LMNAMAPT
SCHEMBL6824881 0.73 SETD7 (0.36) SETD7TP53CYP2D6CYP1A2DRD3
SCHEMBL219752 0.72 TSHR (0.36) SETD7TP53CYP2D6CYP1A2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 US disclosed
US-8252919-B2 2′-hydroxy-protected ribonucleoside derivative and production method thereof KANEKA CORPORATION (JP) 2012-08-28 US disclosed
US-20110009609-A1 2'-HYDROXY-PROTECTED RIBONUCLEOSIDE DERIVATIVE AND PRODUCTION METHOD THEREOF KANEKA CORPORATION (JP) 2011-01-13 US disclosed
EP-2258709-A1 2'-HYDROXYL-PROTECTED RIBONUCLEOSIDE DERIVATIVE AND MANUFACTURING METHOD OF SAME Kaneka Corporation (JP) 2010-12-08 EP disclosed
US-20090275753-A1 ORTHO-SUBSTITUTED ANILINE DERIVATIVE AND ANTIOXIDANT DRUG NIPPON SODA CO., LTD. (JP) 2009-11-05 US disclosed
US-7569694-B2 Coumarin compound, material for light emitting device and organic electroluminescent device CHISSO CORPORATION (JP) 2009-08-04 US disclosed
EP-1944024-A1 O-SUBSTITUTED ANILINE DERIVATIVE AND ANTIOXIDANT DRUG NIPPON SODA CO., LTD. (JP) 2008-07-16 EP disclosed
US-20070176544-A1 Coumarin compound, material for light emitting device and organic electroluminescent device JNC CORPORATION (JP) 2007-08-02 US disclosed
US-5665885-A FOR STABILIZING ORGANIC MATERIAL AGAINST THE DAMAGING INFLUENCE OF LIGHT, OXYGEN AND/OR HEAT CIBA-GEIGY CORPORATION (US) 1997-09-09 US disclosed
US-5637714-A OXIDATION AND HEAT RESISTANCE; PHOTOSTABILITY CIBA-GEIGY CORPORATION (US) 1997-06-10 US disclosed
US-5510402-A STABILIZING POLYOLEFINS AND STYRENE COPOLYMERS AGAINST HEAT, OXIDATION AND ACTINIC RADIATION CIBA-GEIGY CORPORATION (US) 1996-04-23 US disclosed
US-5457204-A For polymers CIBA-GEIGY CORPORATION (US) 1995-10-10 US disclosed
EP-0634399-A1 Adducts of hindered amine-epoxides as stabilisers CIBA-GEIGY AG (CH) 1995-01-18 EP disclosed
US-4713186-A PHOSPHATE AND GRAPHITE OR INTERCALATION COMPOUND LONZA LTD. (CH) 1987-12-15 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 (5 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 SETD7 3533/4885TP53 4315/4885CYP2D6 881/4885
US-20110009609-A1 2'-HYDROXY-PROTECTED RIBONUCLEOSIDE DERIVATIVE AND PRODUCTION METHOD THEREOF RNASEL, RNASEH1, NUDT1 SETD7 1439/4885TP53 3962/4885CYP2D6 1550/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 SETD7 3533/4885TP53 4315/4885CYP2D6 881/4885
US-20070176544-A1 Coumarin compound, material for light emitting device and organic electroluminescent device TRPA1, CYP3A4, UGT1A10 SETD7 2423/4885TP53 4214/4885CYP2D6 76/4885
US-20090275753-A1 ORTHO-SUBSTITUTED ANILINE DERIVATIVE AND ANTIOXIDANT DRUG NFE2L2, OXSR1, AOX1 SETD7 1165/4885TP53 4164/4885CYP2D6 2216/4885

“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.