SCHEMBL28544266

SCHEMBL28544266

O=C(O)CCC(Cl)C(Cl)Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.50
TET2 Q6N021 3/20 0.46
KDM4A O75164 2/20 0.46
KDM4C Q9H3R0 2/20 0.46
KDM2A Q9Y2K7 2/20 0.46
TET3 O43151 1/20 0.46
CYP1A2 P05177 2/20 0.44
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRA4 P48169 2/20 0.44
GABRE P78334 2/20 0.44
GABRA6 Q16445 2/20 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
SCHEMBL9430288 0.79 FOLH1 (0.52) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL1132263 0.79 GABRP (0.52) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL11765423 0.77 FOLH1 (0.55) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL911280 0.77
SCHEMBL6913774 0.74
SCHEMBL371925 0.74
SCHEMBL3755409 0.74
SCHEMBL7040470 0.74 GABRP (0.52) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL10522525 0.74 GABRP (0.46) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL1131636 0.72

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-112521483-A Preparation method of ularitide 深圳翰宇药业股份有限公司 2021-03-19 CN claimed
CN-112521483-A Preparation method of ularitide 深圳翰宇药业股份有限公司 2021-03-19 CN disclosed