SCHEMBL7934286

SCHEMBL7934286

CC1=Cc2c(-c3ccc(Br)cc3)cccc2C1[Zr](Cl)Cl

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
NPC1 O15118 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL6889133 0.88 EDNRB (0.32)
SCHEMBL27463750 0.87 PTGS2 (0.33) NPC1TSHRRAB9ASMN1; SMN2SLC6A3
SCHEMBL3163967 0.87 BRD4 (0.33)
SCHEMBL7199373 0.86 HTR2C (0.34) SLC6A3
SCHEMBL27464143 0.83 BRD4 (0.35)
SCHEMBL7203232 0.83 BRD4 (0.35) NPC1TSHRRAB9ASMN1; SMN2
SCHEMBL27493782 0.83
SCHEMBL8165787 0.83 BRD4 (0.35) TSHR
SCHEMBL7598774 0.83 EDNRB (0.34)
SCHEMBL27565547 0.83 CD274 (0.36) MAOB

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
CN-1138680-C Container for heating and sterilizing ������ѧ��ʽ���� 2004-02-18 CN disclosed
US-20010014718-A1 RESIN COMPOSITIONS AND USE OF THE SAME MITSUI CHEMICALS, INC. (JP) 2001-08-16 US disclosed
EP-0801047-B1 NORBORNENE COMPOUNDS HAVING CHAIN POLYENE GROUPS AND UNSATURATED ETHYLENIC COPOLYMER PRODUCED WITH THE USE OF THE SAME MITSUI CHEMICALS INC (JP) 2000-04-05 EP disclosed
CN-1217685-A VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION AND PAINTED ELASTOMER COMPOSITION MITSUI CHEMICALS INC (JP) 1999-05-26 CN disclosed
CN-1216053-A SHRINKABLE FILM MADE FROM OLEFINE COPOLYMER MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed
CN-1216055-A RUBBER COMPOSITIONS FOR TIRES MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed