SCHEMBL11554181

SCHEMBL11554181

Cc1oc2cc(O)cc(O)c2c(=O)c1-c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.72
KMT2A Q03164 5/20 0.72
HSP90AA1 P07900 1/20 0.72
CASP1 P29466 1/20 0.65
CASP7 P55210 1/20 0.65
ALDH1A1 P00352 5/20 0.64
KDM4E B2RXH2 4/20 0.64
MAPT P10636 6/20 0.62
ABCB1 P08183 4/20 0.62
CYP3A4 P08684 3/20 0.62
CA12 O43570 2/20 0.62
CYP1A1 P04798 2/20 0.62
CYP1A2 P05177 2/20 0.62
CYP2D6 P10635 2/20 0.62
CYP19A1 P11511 2/20 0.62
CYP2C9 P11712 2/20 0.62
MAOA P21397 2/20 0.62
CA4 P22748 2/20 0.62
MAOB P27338 2/20 0.62
CYP2C19 P33261 2/20 0.62

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
SCHEMBL5040391 0.90 MEN1 (0.70) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL9755685 0.87 ALDH1A1 (0.63) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL28514417 0.87 ALDH1A1 (0.63) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL11627119 0.86 MEN1 (0.66) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL12940979 0.84 MEN1 (1.00) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL30527883 0.82 MEN1 (0.67) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL11550487 0.81 ALDH1A1 (0.55) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL27928272 0.80 ERAP1 (0.64) MEN1KMT2AHSP90AA1CASP1CASP7
SCHEMBL12636895 0.80 CYP3A4 (0.74) MEN1KMT2AHSP90AA1ALDH1A1KDM4E
SCHEMBL10619789 0.79 GLO1 (0.78) MEN1KMT2AHSP90AA1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2277595-A2 Compounds for immunopotentiation Novartis Vaccines and Diagnostics, Inc. (US) 2011-01-26 EP disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
US-4166862-A WEIGHT-GAIN PROMOTERS CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1979-09-04 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-20100226931-A1 Compounds for immunopotentiation LY96, ICOS, PDCD1 MEN1 3603/4885KMT2A 1703/4885HSP90AA1 4140/4885

“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.