SCHEMBL2335362

SCHEMBL2335362

Cc1cc(C)c(NCCCCCNc2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 12/20 0.50
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
ACHE P22303 1/20 0.36

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
SCHEMBL5845349 0.93 RAPGEF4 (0.52) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL16378511 0.92 L3MBTL1 (0.49) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
Bromide SCHEMBL28822892 0.90 L3MBTL1 (0.47) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL2756366 0.87 RAPGEF4 (0.57) RAPGEF4ALDH1A1MAPTLMNA
SCHEMBL3890402 0.87 RAPGEF4 (0.43) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL21015410 0.86 MAPT (0.56) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL6065939 0.85 RAPGEF4 (0.44) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL5387467 0.85 RAPGEF4 (0.44) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
Bromide SCHEMBL813517 0.83 RAPGEF4 (0.43) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1
Hydrochloric Acid SCHEMBL813568 0.83 RAPGEF4 (0.43) RAPGEF4ALDH1A1MAPTTDP1L3MBTL1

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-20140005429-A1 Processes for the Preparation of Arylamine Compounds UNIVATION TECHNOLOGIES, LLC (US) 2014-01-02 US disclosed
US-8501659-B2 Processes for the preparation of arylamine compounds UNIVATION TECHNOLOGIES, LLC (US) 2013-08-06 US disclosed
US-20110207599-A1 Processes for the Preparation of Arylamine Compounds UNIVATION TECHNOLOGIES, LLC (US) 2011-08-25 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-20110207599-A1 Processes for the Preparation of Arylamine Compounds NAT1, AADAT, AAAS RAPGEF4 3151/4885ALDH1A1 2265/4885MAPT 4096/4885

“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.