SCHEMBL5637809

SCHEMBL5637809

COc1ccc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)C3)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 6/20 0.63
ALDH1A1 P00352 3/20 0.60
BRD4 O60885 2/20 0.60
LMNA P02545 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
KMT2A Q03164 2/20 0.57
KDM4E B2RXH2 1/20 0.57
CYP19A1 P11511 1/20 0.56
GAA P10253 1/20 0.56
MAPK1 P28482 1/20 0.56
ESR1 P03372 1/20 0.55
MAPT P10636 2/20 0.53
MEN1 O00255 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
TRIM24 O15164 1/20 0.52
NLRP3 Q96P20 1/20 0.51

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
SCHEMBL5638869 0.86 PKM (0.62) PKMALDH1A1BRD4LMNASMN1; SMN2
SCHEMBL5638964 0.84 PKM (0.60) PKMALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL5637386 0.84 SMN1; SMN2 (0.60) PKMALDH1A1BRD4LMNASMN1; SMN2
SCHEMBL26932397 0.83 SMN1; SMN2 (0.60) PKMALDH1A1BRD4LMNASMN1; SMN2
SCHEMBL4407221 0.79 TDP2 (0.59) PKMALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL2592757 0.77 PKM (1.00) PKMALDH1A1
SCHEMBL22104701 0.77 SMN1; SMN2 (0.68) PKMALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL153506 0.77 EIF2AK2 (0.74) ALDH1A1GAA
SCHEMBL26538218 0.76 PKM (0.67) PKMLMNASMN1; SMN2KMT2AKDM4E
SCHEMBL5636293 0.76 PKM (0.73) PKMALDH1A1BRD4LMNASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7186745-B2 Indolone derivatives having vascular damaging activity ASTRAZENECA AB (SE) 2007-03-06 US disclosed
US-20040147589-A1 Indolone derivatives having vascular damaging activity ASTRAZENECA AB (SE) 2004-07-29 US disclosed
EP-1370527-A1 INDOLONE DERIVATIVES HAVING VASCULAR-DAMAGING ACTIVITY AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002070478-A1 INDOLONE DERIVATIVES HAVING VASCULAR-DAMAGING ACTIVITY ASTRAZENECA AB (SE) 2002-09-12 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-20040147589-A1 Indolone derivatives having vascular damaging activity HYOU1, IDO1, OXER1 PKM 4024/4885ALDH1A1 1093/4885BRD4 962/4885

“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.