SCHEMBL6504941

SCHEMBL6504941

COc1ccc(C(C(=O)C(c2ccc(OC)cc2)c2ccc(Cl)c(Cl)c2)c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
TP53 P04637 1/20 0.44
SLC6A3 Q01959 2/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 2/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
MEN1 O00255 1/20 0.43
CNR1 P21554 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EGFR P00533 1/20 0.41
S1PR3 Q99500 1/20 0.41

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
SCHEMBL28011370 0.78 AKR1C3 (0.45) KMT2AAKR1C3AKR1C2ALDH1A1
SCHEMBL6504793 0.78 ACP3 (0.61) MAPTTP53KMT2ARAB9AMEN1
SCHEMBL6494407 0.77 APP (0.52) MAPTTP53KMT2ARAB9AMEN1
SCHEMBL8380372 0.77 KMT2A (0.60) KMT2AHPGDLMNA
SCHEMBL485336 0.76 HSP90AA1 (0.45) MAPTKMT2ARAB9ATAS1R3TAS1R1
SCHEMBL18039146 0.74 FFAR1 (0.55) SLC6A3KMT2A
SCHEMBL4743799 0.71 HPGD (0.68) MAPTKMT2ARAB9ATAS1R3TAS1R1
SCHEMBL7973591 0.71 HPGD (0.58) MAPTKMT2ARAB9AMEN1AKR1C3
SCHEMBL2302103 0.71 HPGD (0.58) KMT2ARAB9AMEN1HPGDALDH1A1
SCHEMBL9391336 0.71 CES2 (0.50) MAPTKMT2ARAB9AMEN1CNR1

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-6858739-B2 Indole and benzimidazole 15-lipoxygenase inhibitors WARNER-LAMBERT COMPANY (US) 2005-02-22 US disclosed
US-20040038943-A1 Indole and benzimidazole 15-lipoxygenase inhibitors CONNOR DAVID THOMAS (US) 2004-02-26 US disclosed
EP-1294686-A2 INDOLE DERIVATIVES AND THEIR USE AS 15-LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2003-03-26 EP disclosed
WO-2001096299-A2 INDOLE DERIVATIVES AND THEIR USE AS 15-LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-12-20 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-20040038943-A1 Indole and benzimidazole 15-lipoxygenase inhibitors ALOX15, ALOX5, ALOX12 MAPT 4865/4885TP53 3867/4885SLC6A3 3833/4885

“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.