SCHEMBL8122010

SCHEMBL8122010

C1=CC2(Oc3c1ccc1ccccc31)C1CC3CC(C1)CC2C3

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.33
HTR2A P28223 2/20 0.33
EGFR P00533 1/20 0.33
BRAF P15056 1/20 0.33
ALDH1A1 P00352 3/20 0.31
TSHR P16473 2/20 0.31
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
HTR2B P41595 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL4625971 0.86 HTR2C (0.36) HTR2CHTR2AALDH1A1TSHRHSD17B10
SCHEMBL8910440 0.81
SCHEMBL8868990 0.80 KDM4E (0.39) ALDH1A1TSHRKDM4EMEN1MAPT
SCHEMBL14631751 0.79 SLC6A2 (0.31) HTR2CHTR2ASLC6A4
SCHEMBL8912772 0.79 MAPT (0.38) KDM4EMEN1MAPTKMT2AHTT
SCHEMBL7094838 0.78 AKR1B1 (0.31)
SCHEMBL4538261 0.77 HTR2C (0.34) HTR2CHTR2A
SCHEMBL29756154 0.77 HTR2C (0.34) HTR2CHTR2A
SCHEMBL8823964 0.76 HTR2C (0.31) HTR2CHTR2A
SCHEMBL8681014 0.75 ALDH1A1 (0.39) HTR2CHTR2AALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951445-B2 Photochromic optical article and method of producing the same TOKUYAMA CORPORATION (JP) 2011-05-31 US disclosed
US-7951445-B2 Photochromic optical article and method of producing the same TOKUYAMA CORPORATION (JP) 2011-05-31 US disclosed
EP-0971914-B1 NEUTRAL COLOURING PHOTOCHROMIC 2H-NAPHTHO 1,2-b PYRANS AND HETEROCYCLIC PYRANS VIVIMED LABS EUROP LTD (GB) 2011-05-18 EP disclosed
US-20080226883-A1 Photochromic Optical Article and Method of Producing the Same TOKUYAMA CORPORATION (JP) 2008-09-18 US disclosed
US-20080226883-A1 Photochromic Optical Article and Method of Producing the Same TOKUYAMA CORPORATION (JP) 2008-09-18 US disclosed
EP-0696582-B1 Polycyclic spirophthalimide derivatives, process for their preparation and their use as fulgimides TOKUYAMA CORP (JP) 2000-03-22 EP disclosed
EP-0629626-B1 Cyclopropyl-substituted spiro-photochromic compounds TOKUYAMA CORP (JP) 1999-10-27 EP disclosed
EP-0696582-A1 Polycyclic spirophthalimide derivatives, process for their preparation and their use as fulgimides TOKUYAMA CORPORATION (JP) 1996-02-14 EP disclosed
EP-0629626-A2 Cyclopropyl-substituted spiro-photochromic compounds TOKUYAMA CORPORATION (JP) 1994-12-21 EP disclosed