SCHEMBL6929534

SCHEMBL6929534

CC1=CC([Zr](=C(C)C)C2C=C(C)c3ccccc32)c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
GPR3 P46089 1/20 0.32
PGR P06401 1/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL3683304 0.88 POLB (0.34) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL911070 0.78 GPR3 (0.33) GPR3PGR
SCHEMBL7680681 0.78 POLB (0.33) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7673609 0.77 POLB (0.33) POLBHDAC3HDAC4HDAC7HDAC8
Hydrochloric Acid SCHEMBL5702887 0.77 POLB (0.33) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL6928650 0.77 PTPN1 (0.37) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL6928282 0.77 POLB (0.33) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL6926442 0.77 POLB (0.33) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7677856 0.77 POLB (0.33) POLBHDAC3HDAC4HDAC7HDAC8
Hydrochloric Acid SCHEMBL6909056 0.75 PTPN1 (0.36) POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6518386-B1 Propylene homopolymer having specific characteristics BASELL TECHNOLOGY COMPANY BV (NL) 2003-02-11 US disclosed
US-6448350-B1 Process for the preparation of copolymers of ethylene with alpha-olefins BASELL TECHNOLOGY COMPANY BV (NL) 2002-09-10 US disclosed
EP-0991677-A1 PROCESS FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE WITH ALPHA-OLEFINS Montell Technology Company bv (NL) 2000-04-12 EP disclosed
WO-1999054369-A1 PROCESS FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE WITH ALPHA-OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1999-10-28 WO disclosed