SCHEMBL12588934

SCHEMBL12588934

CC(C)N(C(C)C)p1oc2ccc3ccccc3c2c2c(o1)c(COCc1cc3ccccc3c3c1op(N(C(C)C)C(C)C)oc1ccc4ccccc4c13)cc1ccccc12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ GAA P10253 1/20 0.31
▸ ATM Q13315 1/20 0.30

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
SCHEMBL12588926 0.88 KMT2A (0.35) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL12588930 0.86 KMT2A (0.34) KDM4EKMT2AALDH1A1MAPTNPSR1
SCHEMBL13296135 0.82 HPGD (0.38) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL26935872 0.80 KMT2A (0.31) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL24176530 0.80 MAPT (0.33) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL24176529 0.80 KMT2A (0.31) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL12588944 0.76 KDM4E (0.33) KDM4E
SCHEMBL14001438 0.73 L3MBTL1 (0.34) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL16193207 0.73 L3MBTL1 (0.34) KDM4EKMT2AALDH1A1HPGDMEN1
SCHEMBL16193268 0.72 UGT2B7 (0.41) KMT2AMEN1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964743-B2 Catalyst for asymmetric synthesis, ligand for use therein, and process for producing optically active compound through asymmetric synthesis reaction using them JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-06-21 — — US disclosed
US-7964743-B2 Catalyst for asymmetric synthesis, ligand for use therein, and process for producing optically active compound through asymmetric synthesis reaction using them JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-06-21 — — US disclosed
US-20090156849-A1 Catalyst for Asymmetric Synthesis, Ligand for Use Therein, and Process for Producing Optically Active Compound through Asymmetric Synthesis Reaction Using Them JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-06-18 — — US disclosed
US-20090156849-A1 Catalyst for Asymmetric Synthesis, Ligand for Use Therein, and Process for Producing Optically Active Compound through Asymmetric Synthesis Reaction Using Them JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-06-18 — — US disclosed
EP-1854802-A1 CATALYST FOR ASYMMETRIC SYNTHESIS, LIGAND FOR USE THEREIN, AND PROCESS FOR PRODUCING OPTICALLY ACTIVE COMPOUND THROUGH ASYMMETRIC SYNTHESIS REACTION USING THEM Japan Science and Technology Agency (JP) 2007-11-14 — — 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-20090156849-A1 Catalyst for Asymmetric Synthesis, Ligand for Use Therein, and Process for Producing Optically Active Compound through Asymmetric Synthesis Reaction Using Them ME1, ATIC, ADH1A KDM4E 3842/4885KMT2A 3016/4885ALDH1A1 12/4885

“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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