SCHEMBL3189804

SCHEMBL3189804

C=CCN(C)/C=C/C=C(C#N)C#N

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.35
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
IDE P14735 1/20 0.33
KMT2A Q03164 1/20 0.33
TOP1 P11387 1/20 0.30

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
SCHEMBL3189808 1.00 APP (0.35) APPMEN1USP2POLBMAPT
SCHEMBL9628464 0.81 MEN1 (0.34) APPMEN1USP2POLBMAPT
SCHEMBL9488321 0.81 MEN1 (0.34) APPMEN1USP2POLBMAPT
SCHEMBL13773165 0.77 MEN1 (0.41) APPMEN1POLBKMT2A
Acrylic Acid SCHEMBL11402394 0.74 LMNA (0.33) MEN1USP2POLBMAPTIDE
SCHEMBL10922299 0.73 APP (0.42) APPMEN1MAPTKMT2A
SCHEMBL9892485 0.73 APP (0.42) APPMEN1MAPTKMT2A
SCHEMBL3203789 0.73 CYP2C9 (0.52) MEN1USP2POLBMAPTKMT2A
SCHEMBL11207088 0.72 TDP1 (0.34)
Acrylamide SCHEMBL9488521 0.71 ALDH1A1 (0.34)

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
US-9068080-B2 Merocyanine derivatives BASF SE (DE) 2015-06-30 US disclosed
US-20100035839-A1 MEROCYANINE DERIVATIVES CIBA CORPORATION (US) 2010-02-11 US disclosed
EP-2125961-A1 MEROCYANINE DERIVATIVES Ciba Holding Inc. (CH) 2009-12-02 EP disclosed
WO-2008080645-A1 MEROCYANINE DERIVATIVES CIBA HOLDING INC. (CH) 2008-07-10 WO 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-20100035839-A1 MEROCYANINE DERIVATIVES C1R, MC5R, C2CD5 APP 3148/4885MEN1 603/4885USP2 1999/4885

“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.