SCHEMBL27070117

SCHEMBL27070117

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)NC1CCNCC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SFRP1 Q8N474 6/20 0.53
▸ WNT3 P56703 2/20 0.53
▸ BRD4 O60885 2/20 0.47
▸ BRD2 P25440 2/20 0.47
▸ BRD3 Q15059 2/20 0.47
▸ HDAC4 P56524 1/20 0.45
▸ CCR8 P51685 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ PI4KA P42356 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PIK3C2G O75747 1/20 0.38
▸ MCOLN3 Q8TDD5 1/20 0.38
▸ NMT1 P30419 1/20 0.37

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
SCHEMBL27034291 0.82 KMT2A (0.42) SFRP1WNT3HDAC4ALDH1A1TSHR
SCHEMBL27070111 0.78 SFRP1 (0.39) SFRP1WNT3
SCHEMBL27070114 0.77 SFRP1 (0.56) SFRP1WNT3BRD4HDAC4CCR8
SCHEMBL24529785 0.74 WNT3 (0.54) SFRP1WNT3HDAC4ALDH1A1CYP3A4
SCHEMBL26065736 0.73 ALDH1A1 (0.48) BRD4BRD2BRD3ALDH1A1CYP3A4
SCHEMBL27034226 0.72 PTGS2 (0.36) SFRP1WNT3BRD4HDAC4
SCHEMBL14538236 0.72 ALDH1A1 (0.71) ALDH1A1CYP3A4TSHRKDM4ERECQL
SCHEMBL4616410 0.72 SFRP1 (0.68) SFRP1WNT3CCR8ALDH1A1
SCHEMBL4733987 0.72 SFRP1 (0.58) SFRP1WNT3BRD4BRD2BRD3
SCHEMBL12061693 0.72 KMT2A (0.62) SFRP1WNT3ALDH1A1CYP3A4TSHR

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
WO-2024020156-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2024-01-25 — — WO disclosed
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