SCHEMBL19737593

SCHEMBL19737593

CC(C)c1cc(Cl)c2c(c1)OCCN2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ADRA2A P08913 3/20 0.31
ADRA2C P18825 3/20 0.31
ADRA1D P25100 3/20 0.31
ADRA1A P35348 3/20 0.31
ADRA1B P35368 3/20 0.31
ADRA2B P18089 2/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
EIF4A3 P38919 1/20 0.31
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL19737442 0.82 ADRA2A (0.41) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL20125065 0.81 ALDH1A1 (0.36) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL19751550 0.81 ALDH1A1 (0.36) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL19737654 0.81 ALDH1A1 (0.36) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL19737592 0.78 ALDH1A1 (0.46) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL30954167 0.75 FABP6 (0.41) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL15828688 0.74 MAPT (0.36) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL4870090 0.74 GRM1 (0.36) MAPTALDH1A1GAAHSD17B10ADRA2A
SCHEMBL12412397 0.73 PTGS1 (0.37) MAPTEIF4A3TP53SMN1; SMN2PTGS1
SCHEMBL69296 0.70 ALDH1A1 (0.49) MAPTALDH1A1GAAHSD17B10TP53

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-20200055823-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2020-02-20 US disclosed
US-20170362180-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2017-12-21 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 (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-20170362180-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 MAPT 4550/4885ALDH1A1 1445/4885GAA 3410/4885
US-20200055823-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 MAPT 4550/4885ALDH1A1 1445/4885GAA 3410/4885

“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.