SCHEMBL9616616

SCHEMBL9616616

CCC(C)(C)CC(C)(C)c1ccc(O)cc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.67
ESR1 P03372 14/20 0.54
ESR2 Q92731 12/20 0.54
CYP3A4 P08684 3/20 0.48
LMNA P02545 1/20 0.48
TYR P14679 1/20 0.48
AR P10275 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
HTR6 P50406 1/20 0.48
ESRRG P62508 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KIF11 P52732 1/20 0.39

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
SCHEMBL18622729 0.89 SHBG (0.75) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL20658231 0.83 SHBG (0.80) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL49704 0.82 SHBG (0.64) SHBGESR1ESR2CYP3A4LMNA
Hydrogen Sulfide SCHEMBL11598921 0.80 SHBG (0.61) SHBGESR1ESR2CYP3A4LMNA
Potassium SCHEMBL29827429 0.80 SHBG (0.61) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL9490738 0.80 SHBG (0.61) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL31282065 0.80 SHBG (1.00) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL2811934 0.80 SHBG (0.61) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL29827667 0.80 SHBG (0.61) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL10141 0.80 SHBG (1.00) SHBGESR1ESR2CYP3A4LMNA

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3952132-A ALKALI METAL SALT OF A PHENOL RESIN FUJI PHOTO FILM CO., LTD. (JA) 1976-04-20 US claimed
EP-3114156-B1 NEW COPOLYMERS SUITABLE FOR MAKING MEMBRANES BASF SE (DE) 2017-12-20 EP disclosed
EP-3131131-A1 LIGHT-EMISSION ELEMENT, AND COMPOSITION USED THEREIN Sumitomo Chemical Company Limited (JP) 2017-02-15 EP disclosed
US-9321902-B2 Isoindolo[2, 1-A]quinazoline derivatives for stabilization of organic materials BASF SE (DE) 2016-04-26 US disclosed
US-20150087755-A1 ISOINDOLO[2, 1-A]QUINAZOLINE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIALS BASF SE (DE) 2015-03-26 US disclosed
EP-2828353-A1 ISOINDOLO[2,1-A]QUINAZOLINE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIALS BASF SE (DE) 2015-01-28 EP disclosed
WO-2013139799-A1 ISOINDOLO[2,1-A]QUINAZOLINE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIALS BASF SE (DE) 2013-09-26 WO disclosed
CN-102770415-A Polycyclic compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS INC 2012-11-07 CN disclosed
US-H1019-H Method for forming images on plain paper THE MEAD CORPORATION (US) 1992-02-04 US disclosed
US-5030538-A Method for producing overhead transparencies having high color density images using a double sided image recording material THE MEAD CORPORATION (US) 1991-07-09 US disclosed
US-5017452-A Method for image developing on plain paper utilizing a developer-donor sheet THE MEAD CORPORATION (US) 1991-05-21 US disclosed
US-4337280-A Desensitizer composition FUJI PHOTO FILM CO., LTD. (JP) 1982-06-29 US disclosed
US-4263047-A PHENOLIC RESIN OR METAL SALT OF AROMATIC ACID FUJI PHOTO FILM CO., LTD. (JP) 1981-04-21 US disclosed
US-4230743-A Process for producing pressure-sensitive copying paper FUJI PHOTO FILM CO., LTD. (JP) 1980-10-28 US disclosed
US-4172727-A WHICH REDUCE OR EXTINGUISH CAPABILITY OF DEVELOPERS TO COLOR COLORLESS COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 1979-10-30 US disclosed
US-4147830-A Recording sheet FUJI PHOTO FILM CO., LTD. (JP) 1979-04-03 US disclosed
US-4078493-A Desensitizing using dry reverse lithographic plate FUJI PHOTO FILM CO., LTD. (JA) 1978-03-14 US disclosed
US-4073968-A IRRADIATING A PHOTOCURABLE COMPOSITION FUJI PHOTO FILM CO., LTD. (JA) 1978-02-14 US disclosed
US-3970769-A PHENOL RESIN FUJI PHOTO FILM CO., LTD. (JA) 1976-07-20 US disclosed
US-3952132-A ALKALI METAL SALT OF A PHENOL RESIN FUJI PHOTO FILM CO., LTD. (JA) 1976-04-20 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-20150087755-A1 ISOINDOLO[2, 1-A]QUINAZOLINE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIALS SQLE, MYC, CYP4Z1 SHBG 3791/4885ESR1 2200/4885ESR2 2287/4885

“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.