SCHEMBL30886441

SCHEMBL30886441

NC(=O)Cc1cc(F)c(N)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 2/20 0.35
▸ HDAC6 Q9UBN7 2/20 0.35
▸ ICMT O60725 3/20 0.33
▸ DGAT1 O75907 1/20 0.33
▸ KIF11 P52732 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ CA1 P00915 3/20 0.31
▸ CA2 P00918 3/20 0.31
▸ CA9 Q16790 3/20 0.31
▸ CA12 O43570 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ CA4 P22748 1/20 0.31
▸ CA6 P23280 1/20 0.31
▸ CA5A P35218 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ CA5B Q9Y2D0 1/20 0.31
▸ SLC9A1 P19634 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
SCHEMBL16005219 0.87 DGAT1 (0.36) HDAC1ICMTDGAT1KIF11RORC
SCHEMBL30886492 0.86 KIF11 (0.34) HDAC1HDAC6ICMTDGAT1KIF11
SCHEMBL28382460 0.79 CXCL8 (0.36) HDAC1HDAC6
SCHEMBL24575335 0.78 KDM1A (0.38) HDAC1ICMTDGAT1KIF11RORC
SCHEMBL10547390 0.77 HDAC1 (0.34) HDAC1HDAC6CA1CA2CA9
SCHEMBL15269992 0.77 CYP3A4 (0.36) HDAC1HDAC6CA1CA2CA9
SCHEMBL30886478 0.76 MEN1 (0.38) HTT
SCHEMBL27758219 0.75 ALDH1A1 (0.33) CA1CA2CA9CA12CA4
SCHEMBL4314806 0.74 KIF11 (0.36) HDAC1ICMTDGAT1KIF11RORC
SCHEMBL27604855 0.74 KIF11 (0.33) ICMTDGAT1KIF11RORCHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598927-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Tenvie Therapeutics Inc. (US) 2025-08-13 — — EP disclosed
WO-2024077273-A2 COMPOUNDS, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. (US) 2024-04-11 — — WO disclosed
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