SCHEMBL9167969

SCHEMBL9167969

N#CC(C(=O)Nc1ccc(F)cc1)C(=O)c1nn(-c2ccccc2)c2c1Cc1ccc(F)cc1-2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 12/20 0.43
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
RIPK1 Q13546 1/20 0.41
PIK3CD O00329 1/20 0.41
PIK3R2 O00459 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
PIK3R5 Q8WYR1 1/20 0.41
PIK3R3 Q92569 1/20 0.41
KCNJ6 P48051 2/20 0.39
KCNJ5 P48544 2/20 0.39
KCNJ3 P48549 2/20 0.39
P2RY1 P47900 1/20 0.38
CHUK O15111 1/20 0.37

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
SCHEMBL8132620 0.97 IKBKB (0.40) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9836709 0.93 IKBKB (0.41) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9173723 0.93 IKBKB (0.44) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9171221 0.93 RIPK1 (0.43) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9173066 0.93 ALDH1A1 (0.41) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9174751 0.92 IKBKB (0.41) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9172086 0.91 IKBKB (0.41) IKBKBALDH1A1LMNARIPK1P2RY1
SCHEMBL9837241 0.91 IKBKB (0.42) IKBKBALDH1A1LMNARIPK1CHUK
SCHEMBL9167849 0.90 IKBKB (0.41) IKBKBALDH1A1LMNARIPK1PIK3CD
SCHEMBL9175603 0.90 IKBKB (0.41) IKBKBALDH1A1LMNARIPK1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5424308-A Immunomodulating agents FARMITALIA CARLO ERBA S.R.L. (IT) 1995-06-13 US claimed
EP-0434807-B1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN STIMULATING MYELOPOIESIS ERBA CARLO SPA (IT) 1994-06-08 EP claimed
EP-0423269-B1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN THE TREATMENT OF RHEUMATOID ARTHRITIS AND OTHER AUTOIMMUNE DISEASES ERBA CARLO SPA (IT) 1994-01-12 EP claimed
EP-0347773-B1 CONDENSED PYRAZOLE 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-04-28 EP claimed
EP-0423269-A1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN THE TREATMENT OF RHEUMATOID ARTHRITIS AND OTHER AUTOIMMUNE DISEASES. ERBA CARLO SPA (IT) 1991-04-24 EP claimed
EP-0422051-A1 CONDENSED PYRAZOLE 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-04-17 EP claimed
WO-1991001309-A1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN STIMULATING MYELOPOIESIS FARMITALIA CARLO ERBA S.R.L. (IT) 1991-02-07 WO claimed
WO-1990011760-A1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN THE TREATMENT OF RHEUMATOID ARTHRITIS AND OTHER AUTOIMMUNE DISEASES FARMITALIA CARLO ERBA S.R.L. (IT) 1990-10-18 WO claimed
WO-1989012630-A1 CONDENSED PYRAZOLE 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.R.L. (IT) 1989-12-28 WO claimed
EP-0347773-A1 Condensed Pyrazole 3-oxo-propanenitrile derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1989-12-27 EP claimed
US-5424308-A Immunomodulating agents FARMITALIA CARLO ERBA S.R.L. (IT) 1995-06-13 US disclosed
EP-0434807-B1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN STIMULATING MYELOPOIESIS ERBA CARLO SPA (IT) 1994-06-08 EP disclosed
EP-0347773-B1 CONDENSED PYRAZOLE 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-04-28 EP disclosed
US-5206258-A Treating autoimmune disorders FARMITALIA CARLO ERBA S.R.L. (IT) 1993-04-27 US disclosed
EP-0422051-A1 CONDENSED PYRAZOLE 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-04-17 EP disclosed
WO-1991001309-A1 HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN STIMULATING MYELOPOIESIS FARMITALIA CARLO ERBA S.R.L. (IT) 1991-02-07 WO disclosed
WO-1989012630-A1 CONDENSED PYRAZOLE 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.R.L. (IT) 1989-12-28 WO disclosed
EP-0347773-A1 Condensed Pyrazole 3-oxo-propanenitrile derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1989-12-27 EP disclosed