SCHEMBL7229754

SCHEMBL7229754

O=C(O)C1C(CO)CC[C@@H]1CO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
PMP22 Q01453 2/20 0.40
TSHR P16473 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
APEX1 P27695 1/20 0.40
GMNN O75496 1/20 0.40
TFPI2 P48307 1/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
THPO P40225 1/20 0.40
GRM2 Q14416 1/20 0.35
GRM3 Q14832 1/20 0.35
GRM8 O00222 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35

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
SCHEMBL7229757 1.00 POLB (0.40) POLBTDP1PMP22TSHRKDM4E
SCHEMBL11350895 0.85 TDP1 (0.34) POLBTDP1PMP22TSHRKDM4E
SCHEMBL21085103 0.77 POLB (0.36) POLBTDP1PMP22TSHRKDM4E
SCHEMBL29517205 0.76
SCHEMBL18975427 0.74 PPP5C (0.33) TDP1TFPI2GRM2GRM3GRM8
SCHEMBL19285086 0.71
SCHEMBL260159 0.71
SCHEMBL8344810 0.71
SCHEMBL744648 0.71
SCHEMBL19616035 0.71

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605604-B1 Tumour necrosis factor alpha release inhibitors; efficiency treatment of cancers, rheumatic diseases, arthritis, ulcers, atherosclerosis, asthma LES LABORATOIRES SERVIER (FR) 2003-08-12 US disclosed
EP-1091937-A1 CARBOXYLIC AND HYDROXAMIC ACID COMPOUNDS INHIBITING METALLOPROTEASES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 2001-04-18 EP disclosed
WO-2000000473-A1 CARBOXYLIC AND HYDROXAMIC ACID COMPOUNDS INHIBITING METALLOPROTEASES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 2000-01-06 WO disclosed