SCHEMBL21157993

SCHEMBL21157993

CCC(C)(C)C(=O)c1cc(C(C)=O)cc(C(C)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA5A P35218 1/20 0.41
▸ LMNA P02545 1/20 0.35
▸ KMT2A Q03164 1/20 0.34
▸ RIPK1 Q13546 12/20 0.33
▸ HSD17B1 P14061 1/20 0.33
▸ CREBBP Q92793 1/20 0.33
▸ PKM P14618 1/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL20081133 0.91 ELANE (0.37) CA5ALMNAKMT2ARIPK1
SCHEMBL13849363 0.85 PPARG (0.36) RIPK1
SCHEMBL17286081 0.85 ALDH1A1 (0.42) LMNAKMT2APKMPOLB
SCHEMBL21158020 0.83 CA5A (0.41) CA5ALMNAKMT2AHSD17B1CREBBP
SCHEMBL21186726 0.79 ACHE (0.46) RIPK1POLB
SCHEMBL21157996 0.79 UNG (0.35) RIPK1POLB
SCHEMBL12948138 0.78 MLYCD (0.42) KMT2ARIPK1
SCHEMBL21919758 0.77 CA5A (0.36) CA5ALMNAKMT2AHSD17B1
SCHEMBL18769406 0.75 CA5A (0.41) CA5ALMNAKMT2AHSD17B1CREBBP
SCHEMBL13334393 0.75 ACHE (0.42) RIPK1POLB

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-3145975-B1 AMINE-DERIVATISED POLYARYLETHERKETONE COPOLYMERS KETONEX LTD (GB) 2021-03-17 — — EP disclosed
EP-3145985-B1 FUNCTIONALIZED POLYMER PARTICLES FOR USE AS TOUGHENING AGENT CYTEC IND INC (US) 2019-07-10 — — EP disclosed
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