SCHEMBL7967778

SCHEMBL7967778

NC(=O)c1c(Cl)c(-c2cccnc2F)n2c1C=CCC2

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.33
FPR1 P21462 1/20 0.32
FPR2 P25090 1/20 0.32
PDE4B Q07343 2/20 0.31
PDE4D Q08499 1/20 0.31
PARP1 P09874 1/20 0.31
CYP11B2 P19099 1/20 0.31
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
DHODH Q02127 2/20 0.31
NAPRT Q6XQN6 1/20 0.30

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
SCHEMBL8329857 0.90 DHODH (0.38) PLAUFPR1FPR2PDE4BPDE4D
SCHEMBL7962199 0.89 DHODH (0.33) FPR1FPR2PDE4BPDE4DPARP1
SCHEMBL7965560 0.89 HPGD (0.32) MKNK1MKNK2DHODH
SCHEMBL7963937 0.87 DHODH (0.37) PLAUPARP1MKNK1MKNK2DHODH
SCHEMBL7967474 0.86 HSP90AA1 (0.35) FPR1FPR2DHODH
SCHEMBL7961614 0.85 PLAU (0.34) PLAUPARP1MKNK1MKNK2DHODH
SCHEMBL7963714 0.84 CYP11B2 (0.34) PLAUPARP1CYP11B2
SCHEMBL7964216 0.84 SQOR (0.35) PLAUPARP1MKNK1MKNK2DHODH
SCHEMBL7963043 0.83 PLAU (0.33) PLAUFPR1FPR2PDE4BPDE4D
SCHEMBL7967747 0.79 DHODH (0.38) PLAUPARP1DHODHNAPRT

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-0946555-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Aventis Pharma S.A. (FR) 1999-10-06 EP claimed
WO-1998025925-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1998-06-18 WO claimed
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US disclosed