SCHEMBL7955537

SCHEMBL7955537

Cc1ncccc1-c1c(Cl)c(C(N)=O)c2n1CCC(Cl)=C2

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ PTPN11 Q06124 4/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CSNK1D P48730 1/20 0.31
▸ CSNK1E P49674 1/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ ACVR1 Q04771 1/20 0.31
▸ P2RX7 Q99572 1/20 0.30
▸ CCNC P24863 1/20 0.30
▸ CDK8 P49336 1/20 0.30
▸ CDK19 Q9BWU1 1/20 0.30
▸ CREBBP Q92793 1/20 0.30
▸ TGFBR1 P36897 1/20 0.30
▸ ABL1 P00519 1/20 0.30
▸ WEE1 P30291 1/20 0.30
▸ EPHB3 P54753 1/20 0.30
▸ PKMYT1 Q99640 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
SCHEMBL7963043 0.89 PLAU (0.33) MKNK1MKNK2ABL1
SCHEMBL7946435 0.89 HPGD (0.34) MKNK1MKNK2
SCHEMBL7961290 0.80 DHODH (0.33) P2RX7ABL1
SCHEMBL7967099 0.80 DHODH (0.34) —
SCHEMBL7955823 0.79 MKNK1 (0.41) MKNK1MKNK2CSNK1DCSNK1ECREBBP
SCHEMBL7952322 0.79 SQOR (0.34) MKNK1MKNK2
SCHEMBL7965202 0.78 HPGD (0.32) —
SCHEMBL7961118 0.78 HSP90AA1 (0.35) PIM1ABL1
SCHEMBL7961927 0.77 IDO1 (0.35) PIM1
SCHEMBL7967778 0.72 PLAU (0.33) 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 3 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 disclosed
EP-0833635-A1 NOVEL USE FOR PYRROLE DERIVATIVES Aventis Pharma S.A. (FR) 1998-04-08 — — EP disclosed
WO-1997000073-A1 NOVEL USE FOR PYRROLE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1997-01-03 — — WO disclosed
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