SCHEMBL3817124

SCHEMBL3817124

COc1ccc2c(ccn2CCCl)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.59
MTNR1A P48039 6/20 0.57
MTNR1B P49286 6/20 0.57
HTR2A P28223 1/20 0.54
HDAC8 Q9BY41 3/20 0.48
HDAC6 Q9UBN7 3/20 0.48
HDAC11 Q96DB2 1/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
HTR7 P34969 1/20 0.46
HDAC3 O15379 2/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC2 Q92769 2/20 0.45
NCOR2 Q9Y618 1/20 0.45
POLB P06746 1/20 0.44
HTR6 P50406 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PRMT5 O14744 2/20 0.44

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
SCHEMBL18857024 0.85 MTNR1A (0.62) HTR2CMTNR1AMTNR1BHTR2AHDAC8
SCHEMBL4204521 0.83 MTNR1A (0.60) HTR2CMTNR1AMTNR1BHTR2AHDAC8
SCHEMBL18857020 0.83 HTR2C (0.59) HTR2CMTNR1AMTNR1BHTR2AHDAC8
SCHEMBL6803161 0.83 HTR2C (0.63) HTR2CMTNR1AMTNR1BHTR2AHDAC8
SCHEMBL10413240 0.82 MTNR1A (0.59) HTR2CMTNR1AMTNR1BHTR2AHDAC8
SCHEMBL7232114 0.81 HTR2C (0.64) HTR2CMTNR1AMTNR1BHTR2AKDM4E
SCHEMBL23956095 0.81 HTR7 (0.67) HTR2CMTNR1AMTNR1BHTR2AHTR7
SCHEMBL3332582 0.81 HTR2C (0.81) HTR2CMTNR1AMTNR1BHTR2AKDM4E
SCHEMBL18857083 0.81 HTR2C (0.64) HTR2CMTNR1AMTNR1BHTR2AHDAC8
SCHEMBL18856948 0.81 MTNR1A (0.58) HTR2CMTNR1AMTNR1BHTR2AHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1048981-B1 Methode for negative type image recording FUJIFILM CORP (JP) 2009-08-19 EP disclosed
US-6416939-B1 EXPOSURE, HEATING AND DEVELOPMENT FUJI PHOTO FILM CO., LTD. (JP) 2002-07-09 US disclosed
EP-1048981-A1 Negative type image recording material FUJI PHOTO FILM CO., LTD. (JP) 2000-11-02 EP disclosed