SCHEMBL25793571

SCHEMBL25793571

CCNCCCNC(=O)CCOCCOCCOCCOCCNCC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
CASP2 P42575 1/20 0.41
SAT1 P21673 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CYP2C19 P33261 2/20 0.39
GLA P06280 1/20 0.39
NAAA Q02083 1/20 0.39
CYP1A2 P05177 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FAAH O00519 1/20 0.37
POLB P06746 1/20 0.36
EPHX2 P34913 1/20 0.35
DNM1 Q05193 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL24813893 0.92 TSHR (0.40) TSHRCASP2SAT1MEN1KMT2A
SCHEMBL20469919 0.87 CASP2 (0.42) TSHRCASP2MEN1KMT2ANAAA
SCHEMBL25791257 0.87 TP53 (0.41) TSHRCASP2SAT1MEN1KMT2A
SCHEMBL24982536 0.87 MEN1 (0.40) TSHRCASP2MEN1KMT2ANAAA
SCHEMBL24811366 0.86 TSHR (0.38) TSHRCASP2MEN1KMT2ACYP2C19
SCHEMBL25793735 0.86 HPGD (0.40) TSHRCASP2MEN1KMT2ANAAA
SCHEMBL25793560 0.86 KDM4E (0.40) TSHRCASP2MEN1KMT2ASMN1; SMN2
SCHEMBL15679068 0.81 LMNA (0.36) SAT1MEN1KMT2ASMN1; SMN2
SCHEMBL12312753 0.81 SMN1; SMN2 (0.55) TSHRSMN1; SMN2POLBEPHX2
SCHEMBL26482295 0.81 MEN1 (0.41) MEN1KMT2ACYP2C19SMN1; SMN2EPHX2

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-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed