SCHEMBL8685158

SCHEMBL8685158

C1=CC2(Oc3ccccc31)Oc1ccccc1C=C2c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
UBE2N P61088 1/20 0.34
KMT2A Q03164 1/20 0.34
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL8680335 0.86 NPSR1 (0.42) HTR2CHTR2BNPSR1
SCHEMBL9333313 0.84 HTR2C (0.32) HTR2CHTR2B
SCHEMBL8680628 0.83 ADRA1D (0.37) HTR2CHTR2BHTTNPSR1
SCHEMBL8680334 0.83 ADRA1D (0.33)
SCHEMBL3877465 0.83 CA12 (0.33) HTR2CHTR2BHTTMEN1MAPT
SCHEMBL8680556 0.81 KDM4E (0.44) HTTMEN1TP53MAPTTSHR
SCHEMBL8680420 0.81 KDM4E (0.39) HTR2CHTR2BHTTNPSR1MEN1
SCHEMBL6701609 0.81 CYP2C19 (0.35) HTTNPSR1TSHR
SCHEMBL4005975 0.81 CYP2C19 (0.35) HTTNPSR1TSHR
SCHEMBL8684835 0.81 MEN1 (0.43) HTTMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US claimed
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US disclosed
US-5710420-A Method for embedding and recovering machine-readable information XEROX CORPORATION (US) 1998-01-20 US disclosed
US-5633109-A Ink compositions with liposomes containing photochromic compounds XEROX CORPORATION (US) 1997-05-27 US disclosed
US-5593486-A Photochromic hot melt ink compositions XEROX CORPORATION (US) 1997-01-14 US disclosed
US-5551973-A LIQUID CRYSTAL GEL PHASE, MICROEMULSION PHASE XEROX CORPORATION (US) 1996-09-03 US disclosed