SCHEMBL14327783

SCHEMBL14327783

CC(C)(C)c1ccc(O)c(-c2cc3ccccc3c(-c3c(O)c(-c4cc(C(C)(C)C)ccc4O)cc4ccccc34)c2O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ GPR84 Q9NQS5 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ HSP90AB1 P08238 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ ALOX5 P09917 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ HSD17B2 P37059 1/20 0.39
▸ CYP2D6 P10635 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ PLA2G1B P04054 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
SCHEMBL14327773 0.90 GPR84 (0.47) MEN1KMT2AGAAPOLBGPR84
SCHEMBL14327784 0.82 HSP90AA1 (0.48) MEN1KMT2AGAAPOLBGPR84
SCHEMBL14327803 0.80 MEN1 (0.48) MEN1KMT2AGAAPOLBGPR84
SCHEMBL17500131 0.80 MEN1 (0.50) MEN1KMT2AGAAPOLBHSP90AA1
SCHEMBL22229788 0.79 GPR84 (0.48) MEN1KMT2AGAAPOLBGPR84
SCHEMBL12786270 0.77 NQO1 (0.46) MEN1KMT2AGPR84ALDH1A1HSD17B10
SCHEMBL6240718 0.77 ALDH1A1 (0.70) MEN1KMT2AGAAHSP90AA1HSP90AB1
SCHEMBL29785519 0.77 ALDH1A1 (0.70) MEN1KMT2AGAAHSP90AA1HSP90AB1
SCHEMBL14327791 0.77 GUSB (0.48) MEN1KMT2AGAAGPR84HSP90AA1
SCHEMBL14327768 0.76 HSD17B1 (0.55) MEN1KMT2AGAAGPR84HSP90AA1

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-8420847-B2 Bis-phosphate compound and asymmetric reaction using the same NATIONAL UNIVERSITY CORPORATION TOHOKU UNIVERSITY (JP) 2013-04-16 — — US disclosed
US-8420847-B2 Bis-phosphate compound and asymmetric reaction using the same NATIONAL UNIVERSITY CORPORATION TOHOKU UNIVERSITY (JP) 2013-04-16 — — US disclosed
US-20120330038-A1 BIS-PHOSPHATE COMPOUND AND ASYMMETRIC REACTION USING THE SAME API CORPORATION (JP) 2012-12-27 — — 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-20120330038-A1 BIS-PHOSPHATE COMPOUND AND ASYMMETRIC REACTION USING THE SAME AASDHPPT, ALDH7A1, ATIC MEN1 1325/4885KMT2A 4503/4885GAA 744/4885

“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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