SCHEMBL8157744

SCHEMBL8157744

CNC(=O)C(C)N(C(=O)C(CC(C)C)CP(=O)(Cc1ccc(NC(=O)c2ccccc2)cc1)OC)c1ccc(OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 13/20 0.47
▸ RAB9A P51151 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ HDAC3 O15379 1/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC7 Q8WUI4 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC10 Q969S8 1/20 0.43
▸ HDAC11 Q96DB2 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ HDAC9 Q9UKV0 1/20 0.43
▸ HDAC5 Q9UQL6 1/20 0.43
▸ CTSL P07711 1/20 0.42
▸ CTSS P25774 1/20 0.42
▸ CTSK P43235 1/20 0.42
▸ BMP1 P13497 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 2/20 0.40

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
SCHEMBL8150256 0.91 MMP1 (0.58) MMP1RAB9ANPC1
SCHEMBL8155905 0.83 MMP1 (0.46) MMP1CTSLCTSSCTSKMMP2
SCHEMBL8157742 0.83 MMP1 (0.70) MMP1MMP2MMP3MMP9
SCHEMBL7503750 0.81 MMP1 (0.42) MMP1RAB9ANPC1CTSLCTSS
SCHEMBL7506431 0.81 NPC1 (0.45) MMP1RAB9ANPC1LMNAMAPT
SCHEMBL7612425 0.75 MMP1 (0.56) MMP1
SCHEMBL7612394 0.74 MMP1 (0.55) MMP1
SCHEMBL7613098 0.74 MMP1 (0.85) MMP1
SCHEMBL8458038 0.71 MMP1 (0.68) MMP1MMP3
SCHEMBL8639840 0.70 NPC1 (0.40) RAB9ANPC1CTSLCTSSCTSK

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
US-6147061-A ANTIARTHRITIC AGENTS; ANTICANCER AGENTS; ORAL DISEASES PFIZER INC. (US) 2000-11-14 — — US disclosed
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