SCHEMBL430528

SCHEMBL430528

COc1ccc(NC(=O)CCCl)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.60
ALDH1A1 P00352 6/20 0.53
MAPT P10636 4/20 0.53
GAA P10253 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
RAB9A P51151 4/20 0.51
NPC1 O15118 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.48
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL30293239 0.84 ALDH1A1 (0.55) ALDH1A1MAPTGAATDP1L3MBTL1
SCHEMBL426569 0.84 ALDH1A1 (0.55) ALDH1A1MAPTGAATDP1L3MBTL1
SCHEMBL14340498 0.84 TP53 (0.56) TP53ALDH1A1MAPTGAATDP1
SCHEMBL8134803 0.83 TP53 (0.57) TP53ALDH1A1MAPTGAATDP1
SCHEMBL8130639 0.82 TP53 (0.59) TP53ALDH1A1MAPTGAATDP1
SCHEMBL30293244 0.79 CHRM2 (0.50) TP53ALDH1A1MAPTGAATDP1
SCHEMBL1289613 0.79 CHRM2 (0.50) TP53ALDH1A1MAPTGAATDP1
SCHEMBL2095013 0.79 RAB9A (0.58) TP53ALDH1A1MAPTGAATDP1
SCHEMBL8320072 0.79 RAB9A (0.57) TP53ALDH1A1MAPTGAATDP1
SCHEMBL2095011 0.79 RAB9A (0.57) TP53ALDH1A1MAPTGAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8609847-B2 Dihydroquinolinone derivatives TAISHO PHARMACEUTICAL CO., LTD (JP) 2013-12-17 US disclosed
EP-2393802-B1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2013-05-08 EP disclosed
US-20120022064-A1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-26 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 (1 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-20120022064-A1 DIHYDROQUINOLINONE DERIVATIVES PER2, CRY1, BACE1 TP53 3980/4885ALDH1A1 464/4885MAPT 133/4885

“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.