SCHEMBL2158254

SCHEMBL2158254

NC(=O)c1c(Cl)c(-c2cccnc2)n2c1C=CCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 8/20 0.43
MKNK2 Q9HBH9 7/20 0.43
CSNK1D P48730 1/20 0.36
CSNK1E P49674 1/20 0.36
KCNH2 Q12809 1/20 0.36
CYP11B2 P19099 4/20 0.35
P2RX7 Q99572 1/20 0.35
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35
SARM1 Q6SZW1 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
SIRT6 Q8N6T7 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35
SIRT5 Q9NXA8 1/20 0.35
SIRT4 Q9Y6E7 1/20 0.35
IKBKB O14920 1/20 0.34
PKN1 Q16512 1/20 0.34
PKN2 Q16513 1/20 0.34
RET P07949 1/20 0.34

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
SCHEMBL8328721 0.90 MKNK1 (0.38) MKNK1MKNK2CYP11B2P2RX7CYP2A6
SCHEMBL7963276 0.89 CYP11B2 (0.39) MKNK1MKNK2CYP11B2P2RX7CYP2A6
SCHEMBL7965530 0.86 MKNK1 (0.40) MKNK1MKNK2CSNK1DCSNK1ECYP11B2
SCHEMBL7963232 0.86 NR4A2 (0.39) CYP11B2P2RX7
SCHEMBL7965727 0.84 MKNK1 (0.38) MKNK1MKNK2CSNK1DCSNK1ECYP11B2
SCHEMBL7962850 0.84 MKNK1 (0.41) MKNK1MKNK2CSNK1DCSNK1ECYP11B2
SCHEMBL7963174 0.84 MKNK1 (0.37) MKNK1MKNK2CSNK1DCSNK1ECYP11B2
SCHEMBL7953077 0.82 MKNK1 (0.40) MKNK1MKNK2CSNK1DCSNK1EKCNH2
SCHEMBL7967737 0.80 MKNK1 (0.39) MKNK1MKNK2CSNK1DCSNK1EKCNH2
SCHEMBL7965560 0.80 HPGD (0.32) MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194426-B1 CONTROLLING TUMOR NECROSIS FACTOR RHONA-POULENC RORER S.A. (FR) 2001-02-27 US claimed
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
EP-2361253-A1 COMPOUNDS Selcia Limited (GB) 2011-08-31 EP disclosed
US-20110184011-A1 Compounds SELCIA LIMITED (GB) 2011-07-28 US disclosed
WO-2010029364-A1 COMPOUNDS SELCIA LIMITED (GB) 2010-03-18 WO disclosed
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
US-6194426-B1 CONTROLLING TUMOR NECROSIS FACTOR RHONA-POULENC RORER S.A. (FR) 2001-02-27 US disclosed
EP-0946555-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Aventis Pharma S.A. (FR) 1999-10-06 EP disclosed
WO-1998025612-A1 NOVEL THERAPEUTIC APPLICATION OF PYRROLE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1998-06-18 WO disclosed
WO-1998025925-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1998-06-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110184011-A1 Compounds COL1A1, ALDH1A2, COL2A1 MKNK1 3856/4885MKNK2 3481/4885CSNK1D 3631/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.