SCHEMBL5531493

SCHEMBL5531493

CC(Cl)C(Cl)C(Cl)C(Cl)C(Cl)C(Cl)C(C)Cl

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL15835698 1.00 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1TDP1
SCHEMBL23788177 1.00 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1TDP1
SCHEMBL16116610 1.00 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1TDP1
SCHEMBL20174107 1.00 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1TDP1
SCHEMBL5201267 0.82 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1TDP1
Ammonia Solution, Strong SCHEMBL1467329 0.80
SCHEMBL7871131 0.76
SCHEMBL7924495 0.74 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1TDP1
SCHEMBL9841402 0.72
SCHEMBL7109936 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120121861-A1 SURFACE PATTERNING WITH FUNCTIONAL POLYMERS BASF SE (DE) 2012-05-17 US disclosed