SCHEMBL31490873

SCHEMBL31490873

Fc1cc(I)ccc1C(Cl)(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KIF11 P52732 2/20 0.31

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
SCHEMBL79185 0.79 KIF11 (0.48) KIF11
SCHEMBL29453100 0.79 KIF11 (0.48) KIF11
SCHEMBL12083405 0.77 ALDH1A1 (0.32) KIF11
SCHEMBL31433155 0.76 ALDH1A1 (0.42) CYP3A4TSHRMAPK1TDP1KIF11
SCHEMBL11550172 0.76 ALDH1A1 (0.42) CYP3A4TSHRMAPK1TDP1KIF11
SCHEMBL8156993 0.74 CYP3A4 (0.60) CYP3A4TSHRMAPK1TDP1
SCHEMBL20615084 0.74 KIF11 (0.32) KIF11
SCHEMBL31490900 0.73 KIF11 (0.42) CYP3A4TSHRMAPK1TDP1KIF11
SCHEMBL17696934 0.73 KIF11 (0.47) CYP3A4TSHRMAPK1TDP1KIF11
SCHEMBL13860362 0.72 KCNJ11 (0.38) TSHRMAPK1KIF11

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
CN-119661371-A Preparation method of 2-fluoro-4-methylaniline 帕潘纳(北京)科技有限公司 2025-03-21 CN disclosed