SCHEMBL24320125

SCHEMBL24320125

O=c1c2cc(Br)ccc2ncn1-c1ccccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
POLB P06746 2/20 0.48
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ACVR1 Q04771 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRA6 Q16445 1/20 0.43
ATM Q13315 1/20 0.43
MCL1 Q07820 1/20 0.42
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
SLC11A2 P49281 1/20 0.40
CHEK1 O14757 1/20 0.40
PIM1 P11309 1/20 0.40

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
SCHEMBL30704943 0.83 POLB (0.48) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL27157404 0.83 POLB (0.48) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL30656833 0.83 POLB (0.48) MEN1KMT2APOLBACVR1GAA
SCHEMBL24166072 0.83 POLB (0.48) MEN1KMT2APOLBACVR1GAA
SCHEMBL27157351 0.83 POLB (0.44) MEN1KMT2APOLBACVR1GAA
SCHEMBL30047726 0.83 POLB (0.44) MEN1KMT2APOLBACVR1GAA
SCHEMBL8439313 0.82 POLB (0.60) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL30516956 0.82 POLB (0.60) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL3656842 0.81 MEN1 (0.68) MEN1KMT2AACVR1GABRA1GABRG2
SCHEMBL24320130 0.81 IP6K1 (0.46) MEN1KMT2APOLBKDM4EALDH1A1

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
CN-116669769-A Piperidinyl small molecule degradants of HELIOS and methods of use 达纳-法伯癌症研究所公司 2023-08-29 CN disclosed
WO-2022081976-A1 PIPERIDINYL SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-04-21 WO disclosed