SCHEMBL10479012

SCHEMBL10479012

[C-]#[N+]/C(C(=O)OCC)=C1\Sc2ccccc2N1CC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.52
▸ KMT2A Q03164 9/20 0.52
▸ MAPT P10636 6/20 0.52
▸ ALDH1A1 P00352 6/20 0.52
▸ USP2 O75604 4/20 0.52
▸ CRHBP P24387 3/20 0.52
▸ CRHR2 Q13324 3/20 0.52
▸ HPGD P15428 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ BCHE P06276 2/20 0.49
▸ HTT P42858 3/20 0.44
▸ IDE P14735 1/20 0.42
▸ PABPC1 P11940 1/20 0.42
▸ APOBEC3A P31941 1/20 0.42
▸ EIF4H Q15056 1/20 0.42
▸ APOBEC3G Q9HC16 1/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.41
▸ POLB P06746 2/20 0.39

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
SCHEMBL10479013 1.00 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL10479039 0.76 MEN1 (0.70) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL10479040 0.76 MEN1 (0.70) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL10479054 0.74 MEN1 (0.63) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL10479036 0.74 MEN1 (0.63) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL20462345 0.72 ALDH1A1 (0.54) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL11320980 0.71 MEN1 (0.89) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL13750359 0.70 MAPT (0.51) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL13750352 0.69 BCHE (0.52) MEN1KMT2AMAPTALDH1A1USP2
SCHEMBL10036058 0.69 MAPT (0.50) MEN1KMT2AMAPTALDH1A1USP2

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-4839260-A Novel polymethine dyes and UV absorbers and imaging materials for their use EASTMAN KODAK COMPANY (US) 1989-06-13 — — US disclosed
US-4839274-A Novel polymethine dyes and UV absorbers containing a triarylborylisocyano group and imaging compositions containing these dyes EASTMAN KODAK COMPANY (US) 1989-06-13 — — US disclosed
EP-0297872-A2 Novel polymethine dyes and UV absorbers and imaging materials for their use EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-01-04 — — EP disclosed
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