SCHEMBL31099301

SCHEMBL31099301

O=Cc1cc(Br)c(-c2cccs2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.51
ERN1 O75460 6/20 0.40
CYP2A6 P11509 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC1 Q13547 1/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPT P10636 3/20 0.35
PPARG P37231 1/20 0.35
RAB9A P51151 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
NPC1 O15118 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
LMNA P02545 2/20 0.33

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
SCHEMBL31252826 0.91 DPP4 (0.62) DPP4ERN1MEN1KMT2AHDAC1
SCHEMBL8010151 0.81 DPP4 (0.53) DPP4ERN1CYP2A6MEN1KMT2A
SCHEMBL1629985 0.77 KDM4E (0.41) DPP4MEN1KMT2AHDAC1KDM4E
SCHEMBL4819905 0.77 MEN1 (0.41) DPP4CYP2A6MEN1KMT2AHDAC1
SCHEMBL28878431 0.74 MEN1 (0.39) MEN1KMT2AHDAC1KDM4EMAPT
SCHEMBL29839866 0.73 ERN1 (0.47) DPP4ERN1CYP2A6MEN1KMT2A
SCHEMBL8827040 0.73 DPP4 (0.64) DPP4ERN1CYP2A6MEN1KMT2A
SCHEMBL29783022 0.70 PGR (0.38) MEN1KMT2AKDM4EMAPTPPARG
SCHEMBL947395 0.69
SCHEMBL223830 0.69 DPP4 (0.96) DPP4ERN1CYP2A6MEN1KMT2A

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-118576709-A Photosensitive carrier and preparation method and application thereof 大连理工大学 2024-09-03 CN claimed
CN-118576709-A Photosensitive carrier and preparation method and application thereof 大连理工大学 2024-09-03 CN disclosed