SCHEMBL5437400

SCHEMBL5437400

COc1ccc2[nH]c(-c3cccc(OC)n3)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.58
▸ NPC1 O15118 3/20 0.58
▸ MAPT P10636 3/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ ITK Q08881 2/20 0.52
▸ AXL P30530 1/20 0.50
▸ AURKA O14965 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ PDGFRB P09619 2/20 0.46
▸ PDGFRA P16234 2/20 0.46
▸ LOXL2 Q9Y4K0 1/20 0.46
▸ CASP3 P42574 1/20 0.46
▸ SENP8 Q96LD8 1/20 0.46
▸ SENP7 Q9BQF6 1/20 0.46

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
SCHEMBL16424041 0.78 KDR (0.56) KDM4EKMT2AAURKAKDRPDGFRB
SCHEMBL15073408 0.77 KDM4E (0.82) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL179132 0.76 NPC1 (0.53) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL3009057 0.76 KDM4E (0.79) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL28696935 0.75 KDM4E (0.52) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL1429201 0.74 NPC1 (1.00) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL4264688 0.73 KDM4E (0.81) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL6118296 0.73 KDM4E (0.54) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL15347705 0.73 PLAU (0.53) KDM4ENPC1MAPTRAB9AMEN1
SCHEMBL30077179 0.73 PLAU (0.53) KDM4ENPC1MAPTRAB9AMEN1

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-20070054921-A1 Substituted indoles and a process for preparing substituted indoles MERCK & CO., INC. 2007-03-08 — — US claimed
US-20070054921-A1 Substituted indoles and a process for preparing substituted indoles MERCK & CO., INC. 2007-03-08 — — US disclosed
US-20070054921-A1 Substituted indoles and a process for preparing substituted indoles MERCK & CO., INC. 2007-03-08 — — US disclosed
US-20070054921-A1 Substituted indoles and a process for preparing substituted indoles MERCK & CO., INC. 2007-03-08 — — US 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-20070054921-A1 Substituted indoles and a process for preparing substituted indoles IDO1, IDO2, TPH1 KDM4E 316/4885NPC1 3624/4885MAPT 2911/4885

“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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