SCHEMBL5146641

SCHEMBL5146641

CCOCC(=O)Nc1cnc2cc(Br)ccc2c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.49
HPGD P15428 2/20 0.49
KDM4E B2RXH2 3/20 0.44
HSD17B10 Q99714 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 4/20 0.43
RAB9A P51151 3/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 1/20 0.40
NPC1 O15118 2/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 2/20 0.39
TSHR P16473 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL2815220 0.86 HPGD (0.43) ALDH1A1HPGDKDM4EHSD17B10MAPT
SCHEMBL5146626 0.85 GSK3B (0.49) ALDH1A1HPGDKDM4EKMT2ARAB9A
SCHEMBL5147708 0.81 ALDH1A1 (0.40) ALDH1A1HPGDMAPTKMT2ACYP1A2
SCHEMBL3861813 0.81 ALDH1A1 (0.42) ALDH1A1HPGDKDM4EHSD17B10MAPT
Hydrochloric Acid SCHEMBL3864036 0.80 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EHSD17B10MAPT
SCHEMBL31548849 0.77 ALDH1A1 (0.39) ALDH1A1HPGDKDM4EHSD17B10MAPT
SCHEMBL23037489 0.77 EGFR (0.51) NPSR1LMNAHTT
SCHEMBL23037527 0.76 KDM4E (0.42) KDM4EKMT2ARAB9APOLBLMNA
SCHEMBL2723624 0.72 MAPK1 (0.57) ALDH1A1MAPTKMT2ARAB9ANPSR1
SCHEMBL5767044 0.71 NPC1 (0.50) ALDH1A1MAPTRAB9ASMN1; SMN2NPC1

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-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-11-08 US disclosed
WO-2006093514-A2 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-09-08 WO 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-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES IL2, TSLP, IFNG ALDH1A1 521/4885HPGD 773/4885KDM4E 2929/4885

“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.