SCHEMBL9154472

SCHEMBL9154472

CCOP(=O)(CC(=O)CNC(=O)OC(C)(C)C)CC1CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
EPHX1 P07099 1/20 0.38
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
ACACB O00763 6/20 0.34
ACACA Q13085 3/20 0.34
DRD2 P14416 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
BTK Q06187 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
PBK Q96KB5 1/20 0.31

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
SCHEMBL9154376 0.94 EPHX1 (0.43) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL9156326 0.80 TDP1 (0.36) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL8016459 0.78 KMT2A (0.39) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL24938547 0.73 KMT2A (0.45) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL6053122 0.73 MEN1 (0.38) KMT2AALDH1A1MEN1TSHRHSD17B10
SCHEMBL3439097 0.72 KMT2A (0.40) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL7820712 0.72 TDP1 (0.42) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL8827712 0.72 TDP1 (0.42) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL9197708 0.70 TDP1 (0.41) KMT2AALDH1A1MEN1TSHREPHX1
SCHEMBL4714065 0.69 TDP1 (0.52) KMT2AALDH1A1MEN1TSHREPHX1

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
EP-0402312-B1 P-substituted propane-phosphinic acid compounds CIBA GEIGY AG (CH) 1995-01-25 EP disclosed
US-5190934-A Treatment of cognitive and memory disorders CIBA-GEIGY CORPORATION (US) 1993-03-02 US disclosed
EP-0402312-A2 P-substituted propane-phosphinic acid compounds CIBA-GEIGY AG (CH) 1990-12-12 EP disclosed