SCHEMBL10028581

SCHEMBL10028581

CC(C#N)(/N=N/C(C)(C#N)C(=O)NCCO)C(=O)NCCO

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.34
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL10000669 0.88
Water SCHEMBL31205630 0.76 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL10028580 0.74
SCHEMBL35560 0.74 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL35559 0.74 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL17732616 0.74 CNR1 (0.41) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL20846792 0.71 CNR1 (0.40) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL3123112 0.71 ALDH1A1 (0.42) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL605200 0.71 POLB (0.46) CNR1ALDH1A1MEN1USP2MAPT
SCHEMBL12565674 0.71 ALDH1A1 (0.42) CNR1ALDH1A1MEN1USP2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119830-B2 Dual function UV-absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2012-02-21 US disclosed
US-20100168438-A1 DUAL FUNCTION UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS ALCON, INC. (CH) 2010-07-01 US disclosed
US-7709652-B2 Dual function UV-absorbers for ophthalmic lens materials ALCON, INC. (CH) 2010-05-04 US disclosed
US-20080221675-A1 Dual Function UV-Absorbers for Ophthalmic Lens Materials ALCON, INC. (CH) 2008-09-11 US disclosed
US-7396942-B2 Dual function UV-absorbers for ophthalmic lens materials ALCON, INC. (CH) 2008-07-08 US disclosed
US-20070078196-A1 Dual Function UV-Absorbers for Ophthalmic Lens Materials ALCON, INC. (US) 2007-04-05 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 (2 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-20080221675-A1 Dual Function UV-Absorbers for Ophthalmic Lens Materials UACA, CRYAA, CRYAB CNR1 3791/4885ALDH1A1 723/4885MEN1 3205/4885
US-20100168438-A1 DUAL FUNCTION UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS UACA, CRYAA, CRYAB CNR1 3791/4885ALDH1A1 723/4885MEN1 3205/4885

“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.