SCHEMBL19084942

SCHEMBL19084942

c1cncc(-c2ccc(-c3nc4ccccc4o3)cc2)c1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.85
HSD17B10 Q99714 5/20 0.85
MEN1 O00255 2/20 0.85
KMT2A Q03164 2/20 0.85
NPC1 O15118 9/20 0.60
RAB9A P51151 8/20 0.60
SMN1; SMN2 Q16637 6/20 0.60
HPGD P15428 5/20 0.60
CYP1A2 P05177 3/20 0.60
CYP2C19 P33261 3/20 0.60
CYP3A4 P08684 2/20 0.60
LMNA P02545 1/20 0.60
ATM Q13315 1/20 0.59
HDAC6 Q9UBN7 1/20 0.58
KDM4E B2RXH2 7/20 0.57
TP53 P04637 3/20 0.57
HTT P42858 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57

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
SCHEMBL23079703 0.94 ALDH1A1 (0.76) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL23079605 0.94 ALDH1A1 (0.76) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL11773057 0.92 ALDH1A1 (1.00) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL30280651 0.92 ALDH1A1 (1.00) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL30401027 0.92 ALDH1A1 (1.00) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL12231991 0.90 ALDH1A1 (0.78) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL23079700 0.90 ALDH1A1 (0.78) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL12232112 0.89 ALDH1A1 (0.82) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL12232113 0.89 ALDH1A1 (0.82) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL12232099 0.89 ALDH1A1 (0.82) ALDH1A1HSD17B10MEN1KMT2ANPC1

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
WO-2020166630-A1 COMPOUND HAVING BENZAZOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE 保土谷化学工業株式会社 2020-08-20 WO disclosed
CN-109790132-A Compound and organic electroluminescent device with benzoxazole ring structure 保土谷化学工业株式会社 2019-05-21 CN disclosed
US-20170189566-A1 ALPHA-SYNUCLEIN LIGANDS WASHINGTON UNIVERSITY (US) 2017-07-06 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-20170189566-A1 ALPHA-SYNUCLEIN LIGANDS SNCA, PARK7, LRRK2 ALDH1A1 2333/4885HSD17B10 3815/4885MEN1 4044/4885

“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.