SCHEMBL28182002

SCHEMBL28182002

O=C(O)CCC(=O)OC(=O)C(O)C(O)C(=O)O.[NaH].[NaH]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
KDM2A Q9Y2K7 3/20 0.36
EGLN1 Q9GZT9 3/20 0.36
KDM6B O15054 1/20 0.36
KDM5C P41229 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
LMNA P02545 3/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
TET2 Q6N021 3/20 0.35
KDM4A O75164 2/20 0.35
KDM4C Q9H3R0 2/20 0.35
TET3 O43151 1/20 0.35
FOLH1 Q04609 2/20 0.31
RIMKLA Q8IXN7 1/20 0.31
NAALAD2 Q9Y3Q0 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 2/20 0.30
GRM8 O00222 1/20 0.30
GRM6 O15303 1/20 0.30

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
Cadaverine Tartrate SCHEMBL28179966 0.98 TSHR (0.39) TSHRKDM2AEGLN1KDM6BKDM5C
Cadaverine Tartrate SCHEMBL8321372 0.98 TSHR (0.42) TSHRKDM2AEGLN1KDM6BKDM5C
SCHEMBL27314245 0.98 TSHR (0.42) TSHRKDM2AEGLN1KDM6BKDM5C
SCHEMBL7035397 0.94 TSHR (0.46) TSHRKDM2ATET2KDM4AKDM4C
SCHEMBL28775571 0.92 EGLN1 (0.39) TSHRKDM2AEGLN1KDM6BKDM5C
SCHEMBL94759 0.92 TSHR (0.48) TSHRKDM2ATET2KDM4AKDM4C
SCHEMBL1340796 0.92 LMNA (0.43) TSHRKDM2AEGLN1KDM6BKDM5C
SCHEMBL27625179 0.90 TSHR (0.46) TSHRKDM2ATET2KDM4AKDM4C
SCHEMBL1864896 0.83 TSHR (0.43) TSHRLMNAALDH1A1
SCHEMBL27314244 0.82 EGLN1 (0.35) KDM2AEGLN1KDM6BKDM5CPHF8

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
CN-107278149-A The composition combined comprising organic acid 强生消费者公司 2017-10-20 CN disclosed