SCHEMBL12101244

SCHEMBL12101244

CN1/C(=C\C=C(C#N)C#N)OCC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.38
▸ KMT2A Q03164 9/20 0.38
▸ MAPT P10636 6/20 0.38
▸ USP2 O75604 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TNNI3 P19429 1/20 0.38
▸ TNNT2 P45379 1/20 0.38
▸ TNNC1 P63316 1/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ KEAP1 Q14145 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ THRB P10828 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 3/20 0.33
▸ IDE P14735 1/20 0.33
▸ MAPK1 P28482 2/20 0.31
▸ RECQL P46063 1/20 0.31

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
SCHEMBL13398977 0.86 — —
SCHEMBL17445955 0.74 — —
SCHEMBL17445962 0.68 — —
SCHEMBL14095020 0.67 — —
SCHEMBL14539770 0.65 GLO1 (0.49) MEN1KMT2AMAPTUSP2ALDH1A1
SCHEMBL19051046 0.64 MAPT (0.39) MEN1KMT2AMAPTUSP2ALDH1A1
SCHEMBL17897724 0.60 MEN1 (0.32) MEN1KMT2AMAPTUSP2THRB
SCHEMBL11572352 0.58 MEN1 (0.40) MEN1KMT2AMAPTUSP2ALDH1A1
SCHEMBL12240400 0.56 — —
SCHEMBL12511129 0.54 MEN1 (0.40) MEN1KMT2AMAPTUSP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549283-B1 Cosmetic preparation comprising merocyanine derivatives BASF SE (DE) 2012-09-12 — — EP disclosed
US-20080260661-A1 Aminobutadiene-Based Uv Screens FUJI PHOTO FILM B.V. 2008-10-23 — — US disclosed
US-20080260661-A1 Aminobutadiene-Based Uv Screens FUJI PHOTO FILM B.V. 2008-10-23 — — US disclosed
US-7407648-B2 Merocyanine derivatives for cosmetic use CIBA SPECIALTY CHEMICALS CORP. (US) 2008-08-05 — — US disclosed
US-7407648-B2 Merocyanine derivatives for cosmetic use CIBA SPECIALTY CHEMICALS CORP. (US) 2008-08-05 — — 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-20080260661-A1 Aminobutadiene-Based Uv Screens ALAD, AAAS, ALDH7A1 MEN1 1641/4885KMT2A 2884/4885MAPT 1149/4885

“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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