SCHEMBL3667523

SCHEMBL3667523

COc1cc2c(cc1OC)[C@@H](CO)NCC2

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.65
KMT2A Q03164 1/20 0.63
MAOA P21397 2/20 0.62
TSHR P16473 1/20 0.62
GRIN2D O15399 8/20 0.60
GRIN3B O60391 8/20 0.60
GRIN1 Q05586 8/20 0.60
GRIN2A Q12879 8/20 0.60
GRIN2B Q13224 8/20 0.60
GRIN2C Q14957 8/20 0.60
GRIN3A Q8TCU5 8/20 0.60
KDM4C Q9H3R0 1/20 0.59
RAB9A P51151 1/20 0.56

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
SCHEMBL1817701 1.00 BCHE (0.65) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL1818727 0.91 BCHE (0.56) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL13193018 0.91 BCHE (0.56) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL29515771 0.88 HTR2C (0.57) BCHEKMT2A
SCHEMBL1818790 0.86 KMT2A (0.64) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL13193462 0.86 KMT2A (0.64) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL30400654 0.85 BCHE (0.60) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL13073125 0.85 BCHE (0.60) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL7851268 0.84 KMT2A (0.71) BCHEKMT2AMAOATSHRGRIN2D
SCHEMBL11819007 0.84 KMT2A (0.63) BCHEKMT2AMAOATSHRGRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9163007-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2015-10-20 US disclosed
US-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-11-20 US disclosed
US-8648069-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2014-02-11 US disclosed
CN-101790526-A 5-heteroaryl substituted indazoles as kinase inhibitors ABBOTT GMBH & CO KG 2010-07-28 CN disclosed
EP-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP disclosed
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 US disclosed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 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-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 BCHE 3956/4885KMT2A 1399/4885MAOA 3445/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 BCHE 3956/4885KMT2A 1399/4885MAOA 3445/4885

“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.