SCHEMBL803040

SCHEMBL803040

CC1(C)c2ccccc2N(c2ccc(-c3ccccc3)cc2)c2cc3c4cc5c(cc4n(-c4ccc(-c6ccccc6)cc4)c3cc21)C(C)(C)c1ccccc1N5c1ccc(-c2ccccc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 3/20 0.34
▸ FAAH O00519 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ ADAMTS5 Q9UNA0 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ PDE6D O43924 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.31
▸ PGR P06401 1/20 0.31
▸ ITGB2 P05107 1/20 0.30
▸ ICAM1 P05362 1/20 0.30
▸ ITGAL P20701 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ AVPR1A P37288 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
SCHEMBL782443 0.95 HDAC4 (0.39) EGLN1FAAHMGLLADAMTS5HDAC4
SCHEMBL802643 0.94 L3MBTL1 (0.41) EGLN1ADAMTS5HDAC4PGRKMT2A
SCHEMBL801967 0.94 L3MBTL1 (0.41) EGLN1ADAMTS5HDAC4PGRKMT2A
SCHEMBL14296755 0.88 HDAC4 (0.35) EGLN1FAAHMGLLADAMTS5HDAC4
SCHEMBL14296784 0.88 HDAC4 (0.35) EGLN1FAAHMGLLADAMTS5HDAC4
SCHEMBL14296740 0.87 ATM (0.36) EGLN1FAAHMGLLADAMTS5HDAC4
SCHEMBL802990 0.87 KDM4E (0.46) ADAMTS5HDAC4NPSR1PGRITGB2
SCHEMBL22104407 0.87 KDM4E (0.37) ADAMTS5HDAC4
SCHEMBL14296739 0.86 KDM4E (0.33) EGLN1FAAHMGLLADAMTS5HDAC4
SCHEMBL802085 0.86 HDAC4 (0.33) HDAC4PDE6DPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9537105-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-01-03 — — US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 — — US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 — — US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 — — US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 — — US disclosed
WO-2010136109-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-02 — — 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-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 EGLN1 4065/4885FAAH 4529/4885MGLL 4070/4885
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 EGLN1 4065/4885FAAH 4529/4885MGLL 4070/4885

“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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