SCHEMBL29957451

SCHEMBL29957451

O=Cc1ccc(Cl)c(F)n1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.46
TERT O14746 11/20 0.40
S1PR4 O95977 2/20 0.38
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RRM2 P31350 1/20 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
SCHEMBL21236197 0.80 LMNA (0.32) ALDH1A1KMT2A
SCHEMBL29954773 0.77 CCR1 (0.50) CCR1TERTS1PR4ALDH1A1RRM2
SCHEMBL29953577 0.74 CCR1 (0.46) CCR1TERTALDH1A1RRM2
SCHEMBL29956032 0.74 CCR1 (0.46) CCR1TERTS1PR4ALDH1A1
SCHEMBL29954702 0.74 CCR1 (0.46) CCR1TERTS1PR4ALDH1A1TDP1
SCHEMBL24665932 0.74 CCR1 (0.46) CCR1TERTALDH1A1RRM2
SCHEMBL25207516 0.74 CCR1 (0.46) CCR1TERTS1PR4ALDH1A1TDP1
SCHEMBL29951115 0.74 CCR1 (0.46) CCR1TERTS1PR4ALDH1A1TDP1
SCHEMBL16822477 0.74 CCR1 (0.46) CCR1TERTS1PR4ALDH1A1
SCHEMBL29820201 0.74 CCR1 (0.46) CCR1TERTALDH1A1RRM2

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed