SCHEMBL23079877

SCHEMBL23079877

c1cc(-c2ccc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4ccc(-c5nc6ccccc6o5)cc4)n3)cc2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 6/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ KDM4E B2RXH2 5/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ HPGD P15428 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ TP53 P04637 3/20 0.49
▸ PKM P14618 1/20 0.49
▸ NPC1 O15118 6/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ ATM Q13315 1/20 0.48
▸ HPSE Q9Y251 3/20 0.44
▸ MAPT P10636 2/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ MMP8 P22894 1/20 0.41
▸ MMP13 P45452 1/20 0.41
▸ HCRTR1 O43613 1/20 0.40
▸ USP2 O75604 1/20 0.40

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
SCHEMBL23079867 0.97 HSD17B10 (0.48) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23079612 0.97 HSD17B10 (0.50) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23079839 0.96 SMN1; SMN2 (0.46) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23079891 0.95 SMN1; SMN2 (0.45) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23079976 0.95 SMN1; SMN2 (0.45) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23118514 0.94 KDM4E (0.48) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23118822 0.94 KDM4E (0.48) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23079866 0.92 HPSE (0.50) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23079665 0.91 SMN1; SMN2 (0.42) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL10065406 0.91 HSD17B10 (0.49) HSD17B10SMN1; SMN2KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210070717-A1 ORGANIC COMPOUND BASED ON TRIAZINE AND BENZOXAZOLE AND APPLICATION THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2021-03-11 — — 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-20210070717-A1 ORGANIC COMPOUND BASED ON TRIAZINE AND BENZOXAZOLE AND APPLICATION THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE OCIAD1, EED, OCIAD2 HSD17B10 2239/4885SMN1; SMN2 4531/4885KDM4E 1651/4885

“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.

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