SCHEMBL12858712

SCHEMBL12858712

Cc1c(C)n(CC(O)CNC(CO)(CO)CO)c2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.61
▸ ALDH1A1 P00352 8/20 0.61
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ MAPT P10636 3/20 0.60
▸ L3MBTL1 Q9Y468 2/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ GAA P10253 1/20 0.58
▸ HSD17B10 Q99714 3/20 0.55
▸ ALOX15 P16050 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ IDO1 P14902 1/20 0.53
▸ POLB P06746 1/20 0.48
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ DNM1 Q05193 4/20 0.46
▸ PER2 O15055 1/20 0.46
▸ CRY1 Q16526 1/20 0.46
▸ CRY2 Q49AN0 1/20 0.46

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
SCHEMBL21093003 0.86 BACE1 (0.62) KDM4EALDH1A1SMN1; SMN2L3MBTL1HSD17B10
SCHEMBL10257256 0.79 ALDH1A1 (0.90) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL410782 0.77 ALDH1A1 (0.78) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
Oxalic Acid SCHEMBL411198 0.75 ALDH1A1 (1.00) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL411197 0.75 ALDH1A1 (0.75) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL15570508 0.74 KDM4E (0.61) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL411693 0.73 ALDH1A1 (1.00) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL18862339 0.73 KDM4E (0.97) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL409536 0.72 MAPT (0.80) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL21093337 0.71 RAD52 (0.53) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2

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-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS WARATAH PHARMACEUTICALS INC. (CA) 2011-02-03 — — US disclosed
US-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS WARATAH PHARMACEUTICALS INC. (CA) 2011-02-03 — — 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-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS APP, BACE1, IAPP KDM4E 4738/4885ALDH1A1 4135/4885MEN1 2310/4885

“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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