SCHEMBL3284191

SCHEMBL3284191

COC(=O)c1cc(Cl)c2cc(Cl)ccc2n1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.52
NQO2 P16083 4/20 0.47
RXFP1 Q9HBX9 1/20 0.47
MRGPRX4 Q96LA9 2/20 0.45
KDM4E B2RXH2 2/20 0.44
NR4A2 P43354 1/20 0.44
CHEK1 O14757 1/20 0.43
ABL1 P00519 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42

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
SCHEMBL30629557 1.00 PLA2G2A (0.52) PLA2G2ANQO2RXFP1MRGPRX4KDM4E
SCHEMBL5638035 0.88 EGFR (0.47) PLA2G2ANQO2RXFP1MRGPRX4NR4A2
SCHEMBL16832481 0.87 PLA2G2A (0.63) PLA2G2ANQO2RXFP1KDM4ENR4A2
SCHEMBL2908784 0.87 PLA2G2A (0.51) PLA2G2ANQO2RXFP1MRGPRX4KDM4E
SCHEMBL28100420 0.85 PLA2G2A (0.58) PLA2G2ANQO2RXFP1KDM4ENR4A2
SCHEMBL22396163 0.85 L3MBTL1 (0.56) NQO2RXFP1KDM4ENR4A2ALDH1A1
SCHEMBL13919628 0.85 NQO2 (0.45) PLA2G2ANQO2KDM4E
SCHEMBL3281931 0.85 PLA2G2A (0.49) PLA2G2ANQO2KDM4EHPGDSMN1; SMN2
SCHEMBL28071639 0.84 PLA2G2A (0.54) PLA2G2ANQO2RXFP1KDM4ENR4A2
SCHEMBL3281879 0.83 KDM4E (0.60) NQO2KDM4EALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300937-A1 Substituted 6-(Pyrimidin-4-yl)Quinoline Compounds as Cyclin Dependent Kinase Inhibitors BEIGENE, LTD. (KY) 2024-09-12 US disclosed
CN-1882568-B Pyrrol derivatives with antibacterial activity ASTRAZENECA AB 2012-03-28 CN disclosed
US-7709503-B2 Pyrrol derivatives with antibacterial activity ASTRAZENECA AB (SE) 2010-05-04 US disclosed
EP-1664025-B1 PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2007-09-19 EP disclosed
CN-1882568-A Pyrrol derivatives with antibacterial activity ASTRAZENECA AB (SE) 2006-12-20 CN disclosed
US-20060223801-A1 Pyrrol derivatives with antibacterial activity ASTRAZENECA AB (SE) 2006-10-05 US disclosed
EP-1664025-A1 PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026149-A1 PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2005-03-24 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 (2 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-20060223801-A1 Pyrrol derivatives with antibacterial activity PEF1, PEPD, PELP1 PLA2G2A 3888/4885NQO2 776/4885RXFP1 2964/4885
US-20240300937-A1 Substituted 6-(Pyrimidin-4-yl)Quinoline Compounds as Cyclin Dependent Kinase Inhibitors CDK4, CDK6, CDK2 PLA2G2A 2723/4885NQO2 809/4885RXFP1 4688/4885

“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.