SCHEMBL23729446

SCHEMBL23729446

CCCCCNC(=O)CCN1CCN(C)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.56
NAAA Q02083 1/20 0.53
KDM4E B2RXH2 2/20 0.50
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.50
USP2 O75604 1/20 0.49
TP53 P04637 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
FAAH O00519 1/20 0.46
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
GNAI3 P08754 1/20 0.45
GNAO1 P09471 1/20 0.45
GNAI1 P63096 1/20 0.45
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
OPRD1 P41143 1/20 0.44
DNM1 Q05193 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL3477552 0.98 CASP2 (0.59) CASP2NAAAKDM4ENPC1ALDH1A1
SCHEMBL24412633 0.93 CASP2 (0.65) CASP2NAAAKDM4EUSP2TP53
SCHEMBL24412952 0.93 CASP2 (0.65) CASP2NAAAKDM4EUSP2TP53
SCHEMBL24412969 0.92 TP53 (0.51) CASP2NAAAALDH1A1TP53SMN1; SMN2
SCHEMBL24412716 0.89 CASP2 (0.59) CASP2NAAAKDM4EALDH1A1TP53
SCHEMBL8437935 0.88 FAAH (0.55) CASP2NAAAKDM4ENPC1ALDH1A1
SCHEMBL20998566 0.87 USP2 (0.56) CASP2NAAAKDM4ENPC1ALDH1A1
SCHEMBL8124655 0.86 PAOX (0.50) CASP2KDM4ETP53SMN1; SMN2MAPT
SCHEMBL17817099 0.86 KDM4E (0.62) CASP2NAAAKDM4EALDH1A1FAAH
SCHEMBL15759109 0.85 SMN1; SMN2 (0.50) CASP2KDM4ENPC1ALDH1A1USP2

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-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed