SCHEMBL9687520

SCHEMBL9687520

CC(=O)Nc1cccc(C)c1CO

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
HPGD P15428 2/20 0.61
MAPK1 P28482 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
TSHR P16473 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
EPHX1 P07099 1/20 0.44
HTT P42858 1/20 0.44
MAOA P21397 1/20 0.42
POLB P06746 2/20 0.42
CYP2C19 P33261 1/20 0.42
PARP14 Q460N5 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL9686952 0.89 ALDH1A1 (0.53) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL8175962 0.87 RAB9A (0.46) ALDH1A1HPGDNPC1RAB9AKMT2A
SCHEMBL9694548 0.84 HPGD (0.47) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL9686214 0.84 POLB (0.51) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL9687629 0.84 ALDH1A1 (0.59) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL9687020 0.83 ALDH1A1 (0.56) ALDH1A1HPGDNPC1RAB9AKMT2A
SCHEMBL9687683 0.83 HPGD (0.46) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL17146147 0.81 MAPT (0.45) ALDH1A1HPGDNPC1RAB9AKMT2A
SCHEMBL9686499 0.80 ALDH1A1 (0.57) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL7462025 0.80 ALDH1A1 (0.54) ALDH1A1HPGDMAPK1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3915371-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE Bayer AG (DE) 2021-12-01 EP disclosed
US-20090203667-A1 PENTADIENAMIDE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-08-13 US disclosed
US-20090203667-A1 PENTADIENAMIDE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-08-13 US disclosed
EP-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP disclosed
US-4920129-A Anti-ulcerative imidazopyridine compounds FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-04-24 US disclosed
US-4831041-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US disclosed
EP-0308917-A2 Imidazopyridine compound, a process for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-03-29 EP disclosed
EP-0268989-A1 Imidazopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 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 (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-20090203667-A1 PENTADIENAMIDE DERIVATIVES PRMT1, REN, NGLY1 ALDH1A1 1143/4885HPGD 2011/4885MAPK1 244/4885

“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.