SCHEMBL5962893

SCHEMBL5962893

O=C(Nc1ccc(I)cc1C(=O)O)OCC(Cl)(Cl)Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPRC P08575 1/20 0.55
▸ PTPN2 P17706 1/20 0.55
▸ PTPN1 P18031 1/20 0.55
▸ PTPRA P18433 1/20 0.55
▸ PTPRB P23467 1/20 0.55
▸ PTPRE P23469 1/20 0.55
▸ PTPN6 P29350 1/20 0.55
▸ CA12 O43570 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ LTC4S Q16873 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ SERPINE1 P05121 4/20 0.38
▸ PPARG P37231 1/20 0.38
▸ PPARA Q07869 1/20 0.38

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
SCHEMBL20460460 0.82 SMN1; SMN2 (0.52) MEN1KMT2AIDO1CYP1A2CYP2C9
SCHEMBL3894309 0.82 PTPRC (0.59) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL7835188 0.80 KDM4E (0.48) KDM4EMEN1KMT2ACYP1A2CYP2C19
SCHEMBL3887267 0.78 PTPRC (0.66) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL3895050 0.76 PTPRC (0.59) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL30517876 0.76 PTPRC (0.59) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL5962815 0.76 KDM4E (0.56) KDM4EHSD17B10MEN1GFERKMT2A
SCHEMBL5966271 0.75 SPHK2 (0.38) KDM4E
SCHEMBL3888954 0.73 PTPRC (0.59) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL5962933 0.73 SMN1; SMN2 (0.50) KDM4EMEN1KMT2ASERPINE1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067511-B2 Pyrrolobenzodiazepines SPIROGEN LIMITED (GB) 2006-06-27 — — US disclosed
US-7049311-B1 Pyrrolbenzodiazepines SPIROGEN LIMITED (GB) 2006-05-23 — — US disclosed
EP-1109812-B1 PYRROLOBENZODIAZEPINES SPIROGEN LTD (GB) 2005-05-04 — — EP disclosed
EP-1413582-A1 Dimeric pyrrolobenzodiazepines Spirogen Limited (GB) 2004-04-28 — — EP disclosed
US-20030120069-A1 Pyrrolobenzodiazepines SPIROGEN LIMITED (GB) 2003-06-26 — — US disclosed
EP-1193270-A2 Pyrrolobenzodiazepines Spirogen Limited (GB) 2002-04-03 — — EP 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-20030120069-A1 Pyrrolobenzodiazepines CNR1, CBX2, CNR2 PTPRC 4411/4885PTPN2 3102/4885PTPN1 3554/4885

“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.

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