SCHEMBL266471

SCHEMBL266471

CCc1n[nH]c(=O)c2cc(C)ccc12

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
AR P10275 5/20 0.44
POLB P06746 1/20 0.44
PRMT5 O14744 10/20 0.44
WDR77 Q9BQA1 9/20 0.43
TSHR P16473 1/20 0.41

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
SCHEMBL24076247 0.93 PRMT5 (0.49) PARP1ALDH1A1SMN1; SMN2ARPRMT5
SCHEMBL27384831 0.85 PARP1 (0.43) PARP1ALDH1A1SMN1; SMN2ARPOLB
SCHEMBL27384835 0.85 PARP1 (0.47) PARP1ALDH1A1SMN1; SMN2ARPOLB
SCHEMBL10147195 0.83 PARP1 (0.48) PARP1ALDH1A1SMN1; SMN2ARPOLB
SCHEMBL29480940 0.82 PRMT5 (0.59) PARP1ALDH1A1SMN1; SMN2ARPOLB
SCHEMBL17825064 0.82 PRMT5 (0.59) PARP1ALDH1A1SMN1; SMN2ARPOLB
SCHEMBL21575781 0.81 PRMT5 (0.49) PARP1ALDH1A1SMN1; SMN2ARPRMT5
SCHEMBL4117496 0.80 GAA (0.51) SMN1; SMN2ARPRMT5WDR77TSHR
SCHEMBL30231202 0.79 PRMT5 (0.68) PARP1ALDH1A1SMN1; SMN2ARPOLB
SCHEMBL7462930 0.79 PRMT5 (0.68) PARP1ALDH1A1SMN1; SMN2ARPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629126-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC. (JP) 2014-01-14 US disclosed
US-8629126-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC. (JP) 2014-01-14 US disclosed
US-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2012-05-31 US disclosed
US-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2012-05-31 US disclosed
US-8133882-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC (JP) 2012-03-13 US disclosed
US-8133882-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC (JP) 2012-03-13 US disclosed
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-08-06 US disclosed
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-08-06 US disclosed
EP-1995240-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-26 EP 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 (2 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-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF P2RY10, P2RY12, P2RY11 PARP1 514/4885ALDH1A1 1934/4885SMN1; SMN2 4576/4885
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF P2RY12, P2RY11, P2RY10 PARP1 499/4885ALDH1A1 2376/4885SMN1; SMN2 4563/4885

“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.