SCHEMBL12424112

SCHEMBL12424112

N#CC(C#N)=CC=C1Sc2ccccc2N1CC1CO1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 13/20 0.46
▸ MEN1 O00255 13/20 0.46
▸ KMT2A Q03164 13/20 0.46
▸ USP2 O75604 4/20 0.46
▸ CRHBP P24387 4/20 0.46
▸ CRHR2 Q13324 4/20 0.46
▸ IDE P14735 1/20 0.46
▸ FNTA P49354 2/20 0.42
▸ FNTB P49356 2/20 0.42
▸ ALDH1A1 P00352 7/20 0.40
▸ HPGD P15428 2/20 0.40
▸ RAB9A P51151 5/20 0.39
▸ LMNA P02545 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HTT P42858 3/20 0.38
▸ POLB P06746 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ ALOX12 P18054 1/20 0.35

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
SCHEMBL11851144 0.83 MEN1 (0.64) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL13410830 0.81 MAPT (0.46) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL11315442 0.76 MEN1 (0.45) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL4313601 0.75 CYP2D6 (0.53) MAPTPOLBNPSR1CYP1A2CYP2D6
SCHEMBL11854170 0.75 MEN1 (0.57) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL11854175 0.75 MEN1 (0.57) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL13445167 0.74 MAPT (0.45) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL13889560 0.73 MAPT (0.52) MAPTMEN1KMT2AUSP2CRHBP
SCHEMBL14979202 0.73 FNTA (0.30) FNTAFNTB
SCHEMBL13890955 0.70 MEN1 (0.31) MAPTMEN1KMT2AUSP2ALDH1A1

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
WO-2011102545-A1 NON-RESONANT TWO-PHOTON ABSORPTION RECORDING MATERIAL AND NON-RESONANT TWO-PHOTON ABSORPTION COMPOUND FUJIFILM CORPORATION (JP) 2011-08-25 — — WO disclosed
US-20090088490-A1 TWO-PHOTON ABSORPTION RECORDING MATERIAL CONTAINING DYE HAVING POLYMERIZABLE GROUP FUJIFILM CORPORATION (JP) 2009-04-02 — — US disclosed
US-20090051988-A1 HOLOGRAPHIC RECORDING MEDIUM AND HOLOGRAPHIC RECORDING APPARATUS FUJIFILM CORPORATION (JP) 2009-02-26 — — US disclosed
EP-2028654-A1 Holographic recording medium and holographic recording apparatus FUJIFILM Corporation (JP) 2009-02-25 — — EP 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-20090088490-A1 TWO-PHOTON ABSORPTION RECORDING MATERIAL CONTAINING DYE HAVING POLYMERIZABLE GROUP DCX, SLC18A2, KCNN2 MAPT 1043/4885MEN1 856/4885KMT2A 1179/4885

“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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