SCHEMBL11549019

SCHEMBL11549019

O=C(Cc1cccs1)CP(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP2C19 P33261 1/20 0.44
POLB P06746 7/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ESR2 Q92731 1/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL8425406 0.83 POLB (0.47) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL7353467 0.82 HPGD (0.60) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL4994046 0.80 SMN1; SMN2 (0.48) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL4994054 0.80 POLB (0.43) HPGDALDH1A1CYP2C19POLBESR2
SCHEMBL22733890 0.78 HPGD (0.51) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL3223780 0.77 HPGD (0.55) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL5045391 0.76 HPGD (0.53) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL27847201 0.76 HPGD (0.53) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL4775992 0.76 HPGD (0.53) HPGDALDH1A1CYP2C19POLBSMN1; SMN2
SCHEMBL28062332 0.76 HPGD (0.53) HPGDALDH1A1CYP2C19POLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4143051-A GREATER TISSUE SPECIFICITY OF ACTION PFIZER INC. (US) 1979-03-06 US disclosed
US-4113723-A TISSUE SPECIFICITY PFIZER INC. (US) 1978-09-12 US disclosed
US-4102894-A TISSUE SPECIFICITY PFIZER INC. (US) 1978-07-25 US disclosed
US-4080368-A PROSTAGLANDINS PFIZER INC. (US) 1978-03-21 US disclosed
US-3980642-A 15-Substitute D-ω-pentanorprostaglandins PFIZER INC. (US) 1976-09-14 US disclosed
US-3956284-A INCREASED TISSUE SPECIFITY OF ACTION PFIZER INC. (US) 1976-05-11 US disclosed