SCHEMBL30193006

SCHEMBL30193006

CCC(C(=O)O)c1cc(F)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 9/20 0.45
AKR1C2 P52895 9/20 0.45
CPN1 P15169 1/20 0.43
CPB2 Q96IY4 1/20 0.43
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
AKR1C1 Q04828 1/20 0.38
PTGS1 P23219 1/20 0.38

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
SCHEMBL31688938 0.87 CPN1 (0.42) AKR1C3AKR1C2CPN1CPB2MEN1
SCHEMBL16963923 0.81 CES2 (0.46) AKR1C3AKR1C2AKR1C1PTGS1
SCHEMBL25002472 0.78 PKM (0.43) AKR1C3AKR1C2AKR1C1PTGS1
SCHEMBL27643664 0.78 CPN1 (0.38) CPN1CPB2MEN1CYP1A2CYP3A4
SCHEMBL1489632 0.77 KCNQ2 (0.50) MEN1CYP3A4KMT2A
SCHEMBL30192806 0.77 PSEN1 (0.48) AKR1C3AKR1C2MEN1CYP1A2CYP3A4
SCHEMBL24875683 0.77 PSEN1 (0.48) AKR1C3AKR1C2MEN1CYP1A2CYP3A4
SCHEMBL30821928 0.77 KCNQ2 (0.50) MEN1CYP3A4KMT2A
SCHEMBL4658268 0.77 LMNA (0.48) AKR1C3AKR1C2MEN1KMT2A
SCHEMBL29009806 0.76 AKR1C3 (0.40) AKR1C3AKR1C2PPARDPPARAAKR1C1

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
EP-4121055-A1 STAT DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2023-01-25 EP disclosed