SCHEMBL200835

SCHEMBL200835

CC(C)=CCC/C(C)=C/CC(O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
FNTA P49354 1/20 0.55
FNTB P49356 1/20 0.55
MEN1 O00255 2/20 0.52
CYP3A4 P08684 2/20 0.52
ALOX15 P16050 2/20 0.52
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.50
ALDH1A1 P00352 2/20 0.50
UGT1A1 P22309 1/20 0.50
SQLE Q14534 5/20 0.48

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
SCHEMBL28182185 0.83 KMT2A (0.50) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL5487439 0.82 KMT2A (0.55) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL9136753 0.82 KMT2A (0.64) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL17867409 0.81 KMT2A (0.57) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL17265221 0.80 ALOX15 (0.34) ALOX15KDM4EALDH1A1
SCHEMBL17265277 0.80 ALOX15 (0.34) ALOX15KDM4EALDH1A1
SCHEMBL18897542 0.79 KMT2A (0.67) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL127329 0.78 KMT2A (0.58) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL536905 0.78 KMT2A (0.58) KMT2AFNTAFNTBMEN1CYP3A4
SCHEMBL8850354 0.78 KMT2A (0.64) KMT2AFNTAFNTBMEN1CYP3A4

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-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
US-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 US disclosed
US-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 US disclosed
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-8088791-B2 Antibacterial agents Biots Scientific Management Pty Ltd (AU) 2012-01-03 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120122918-A1 ANTIBACTERIAL AGENTS ALK, ROS1, ARG1 KMT2A 380/4885FNTA 2004/4885FNTB 243/4885
US-20130072520-A2 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 KMT2A 1011/4885FNTA 1939/4885FNTB 166/4885
US-20150191420-A1 ANTIBACTERIAL AGENTS ALK, ARG1, ROS1 KMT2A 415/4885FNTA 1591/4885FNTB 130/4885
US-20100173933-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 KMT2A 1011/4885FNTA 1939/4885FNTB 166/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.