SCHEMBL10788231

SCHEMBL10788231

CCCCC(=O)Nc1cccnc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.89
POLB P06746 1/20 0.89
FAAH O00519 1/20 0.74
HDAC3 O15379 2/20 0.71
HDAC4 P56524 2/20 0.71
HDAC1 Q13547 2/20 0.71
HDAC7 Q8WUI4 2/20 0.71
HDAC2 Q92769 2/20 0.71
HDAC10 Q969S8 2/20 0.71
HDAC11 Q96DB2 2/20 0.71
HDAC8 Q9BY41 2/20 0.71
HDAC6 Q9UBN7 2/20 0.71
HDAC9 Q9UKV0 2/20 0.71
HDAC5 Q9UQL6 2/20 0.71
TRPV1 Q8NER1 2/20 0.65
SMN1; SMN2 Q16637 3/20 0.61
MEN1 O00255 1/20 0.60
NPC1 O15118 1/20 0.60
CASP3 P42574 1/20 0.60
RAB9A P51151 1/20 0.60

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
SCHEMBL27813733 0.95 LMNA (0.97) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL823570 0.94 LMNA (1.00) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL28315011 0.94 LMNA (1.00) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL16596336 0.94 LMNA (1.00) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL30444393 0.94 LMNA (1.00) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL14415898 0.94 LMNA (1.00) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL8278813 0.90 LMNA (0.78) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL15480449 0.89 HDAC3 (0.88) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL18255374 0.87 FAAH (0.88) LMNAPOLBFAAHHDAC3HDAC4
SCHEMBL13477810 0.86 LMNA (0.81) LMNAPOLBFAAHHDAC3HDAC4

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101242834-A Inhibitors of AKT activity MERCK & CO INC (US) 2008-08-13 CN disclosed
US-4683330-A ANTICOAGULANTS, ANTIULCER AGENTS THE UPJOHN COMPANY (US) 1987-07-28 US disclosed
US-4668814-A ANTIULCER AGENTS, ANTIASHMATICS, ANTICOAGULANTS THE UPJOHN COMPANY (US) 1987-05-26 US disclosed
US-4628110-A Novel 9-substituted carbacyclin analogs THE UPJOHN COMPANY (US) 1986-12-09 US disclosed
US-4621100-A Treatment of osteoporosis with prostaglandins THE UPJOHN COMPANY (US) 1986-11-04 US disclosed
US-4590297-A Novel 9-substituted carbacyclin analogs THE UPJOHN COMPANY (US) 1986-05-20 US disclosed
EP-0087237-B1 CARBACYCLIN ANALOGUES THE UPJOHN COMPANY (US) 1986-05-14 EP disclosed
US-4588823-A 9-substituted carbacyclin analogs THE UPJOHN COMPANY (US) 1986-05-13 US disclosed
EP-0086612-B1 9-SUBSTITUTED CARBACYCLIN ANALOGUES THE UPJOHN COMPANY (US) 1986-05-07 EP disclosed
US-4585886-A 9-Substituted carbacyclin analogs THE UPJOHN COMPANY (US) 1986-04-29 US disclosed
US-4160095-A PROSTAGLANDINS; ANTIINFLAMMATORY AGENTS THE UPJOHN COMPANY (US) 1979-07-03 US disclosed
US-4157441-A PROSTAGLANDINS, ANTIINFLAMMATORY AGENTS THE UPJOHN COMPANY (US) 1979-06-05 US disclosed
US-4151351-A PROSTAGLANDINS, ANTIINFLAMMATORY THE UPJOHN COMPANY (US) 1979-04-24 US disclosed
US-4131738-A 6-Hydroxy-PGE1 compounds THE UPJOHN COMPANY (US) 1978-12-26 US disclosed
US-4128713-A 6,7-Didehydro-PGI1 compounds THE UPJOHN COMPANY (US) 1978-12-05 US disclosed
US-4126744-A PROSTACYCLIN, MUSCLE STIMULANTS, PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1978-11-21 US disclosed
US-4112224-A PROSTAGLANDIN THE UPJOHN COMPANY (US) 1978-09-05 US disclosed
US-4109082-A PROSTACYCLIN ANALOGS; SMOOTH MUSCLE STIMULATORS THE UPJOHN COMPANY (US) 1978-08-22 US disclosed
US-4100192-A Inter-phenylene-PG amides THE UPJOHN COMPANY (US) 1978-07-11 US disclosed
US-4097489-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-06-27 US disclosed