SCHEMBL812899

SCHEMBL812899

C=C(C)C(=O)Oc1ccc(-n2n3c4ccc(C(=O)OC(C)(C)C)cc4n23)c(O)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.37
▸ SRD5A1 P18405 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ GABRA3 P34903 1/20 0.31
▸ GABRA2 P47869 1/20 0.31
▸ SLC7A5 Q01650 1/20 0.30
▸ HTR7 P34969 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
SCHEMBL12445255 0.86 CA12 (0.41) ELANEKMT2ACA12CA1CA2
SCHEMBL13159291 0.86 CA12 (0.41) ELANEKMT2ACA12CA1CA2
SCHEMBL13159290 0.85 SRD5A1 (0.32) SRD5A1CA12CA1CA2CA9
SCHEMBL12445258 0.85 SRD5A1 (0.32) SRD5A1CA12CA1CA2CA9
SCHEMBL13159313 0.81 HSP90AA1 (0.40) ELANESRD5A1
SCHEMBL812972 0.81 HSP90AA1 (0.40) ELANESRD5A1
SCHEMBL13159303 0.79 ACHE (0.36) ELANEKMT2AATM
SCHEMBL812983 0.79 ACHE (0.36) ELANEKMT2AATM
SCHEMBL13795880 0.79 PKM (0.36) ELANEKMT2AATMCA12CA1
SCHEMBL13159292 0.77 ELANE (0.44) ELANEKMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8062562-B2 Method of producing a cellulose ester film KONICA MINOLTA OPTO, INC. (JP) 2011-11-22 — — US disclosed
US-20090202823-A1 Cellulose Ester Film, Polarizing Plate and Display MURAKAMI TAKASHI 2009-08-13 — — US disclosed
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