SCHEMBL14296784

SCHEMBL14296784

CC1(C)c2ccccc2N(c2ccc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)cc2)c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.35
▸ FAAH O00519 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TSPO P30536 1/20 0.33
▸ EGLN1 Q9GZT9 2/20 0.32
▸ NR4A2 P43354 2/20 0.32
▸ PDE6D O43924 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ PGR P06401 1/20 0.31
▸ ITGB2 P05107 1/20 0.31
▸ ICAM1 P05362 1/20 0.31
▸ ITGAL P20701 1/20 0.31
▸ NR3C1 P04150 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ AVPR1A P37288 1/20 0.31

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
SCHEMBL14296755 1.00 HDAC4 (0.35) HDAC4FAAHMGLLKDM4EATM
SCHEMBL14296740 0.99 ATM (0.36) HDAC4FAAHMGLLKDM4EATM
SCHEMBL14296739 0.95 KDM4E (0.33) HDAC4FAAHMGLLKDM4EATM
SCHEMBL14296777 0.95 ATM (0.35) HDAC4FAAHMGLLKDM4EATM
SCHEMBL16865321 0.94 L3MBTL1 (0.44) HDAC4KDM4EATML3MBTL1TSPO
SCHEMBL2453123 0.94 L3MBTL1 (0.44) HDAC4KDM4EATML3MBTL1TSPO
SCHEMBL12333527 0.94 KDM4E (0.34) HDAC4KDM4EATML3MBTL1TSPO
SCHEMBL13557602 0.93 HDAC4 (0.38) HDAC4KDM4EATML3MBTL1TSPO
SCHEMBL15988946 0.92 L3MBTL1 (0.45) HDAC4KDM4EATML3MBTL1TSPO
SCHEMBL14803373 0.92 HDAC4 (0.35) HDAC4FAAHMGLLKDM4EATM

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-10008673-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2018-06-26 — — US disclosed
US-20170155062-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-06-01 — — US disclosed
US-20170155062-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-06-01 — — US disclosed
US-20120319052-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-12-20 — — US disclosed
US-20120319052-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-12-20 — — 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 (3 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-20170155062-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP1B1, CYP1A1, CYP2E1 HDAC4 4756/4885FAAH 3116/4885MGLL 4691/4885
US-10008673-B2 Compounds for electronic devices CYP1B1, CYP1A1, CYP2E1 HDAC4 4756/4885FAAH 3116/4885MGLL 4691/4885
US-20120319052-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP1B1, CYP1A1, CYP2E1 HDAC4 4756/4885FAAH 3116/4885MGLL 4691/4885

“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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