SCHEMBL5880978

SCHEMBL5880978

CCOC(=O)C1(CCCc2ccccc2)CCc2[nH]c3ccccc3c2C1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.52
MEN1 O00255 8/20 0.52
ALDH1A1 P00352 14/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MAPT P10636 2/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 2/20 0.50
PKM P14618 2/20 0.50
NPY1R P25929 1/20 0.48
OPRM1 P35372 1/20 0.46
OPRD1 P41143 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
SCHEMBL5880943 0.86 ACHE (0.44) KMT2AMEN1MAPTLMNA
SCHEMBL5881036 0.84 KMT2A (0.46) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL5880988 0.82 ACHE (0.38) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL5880987 0.81 TACR1 (0.40) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL5881018 0.81 TACR1 (0.40) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL5881013 0.81 TACR1 (0.40) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL5880926 0.78 TACR1 (0.38) KMT2AALDH1A1L3MBTL1
SCHEMBL6609995 0.78 ACHE (0.43) MAPTLMNA
SCHEMBL5880992 0.74 ACHE (0.38) KMT2AMAPTLMNA
SCHEMBL5880983 0.74 ACHE (0.38) KMT2AMAPTLMNA

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-7122570-B2 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2006-10-17 US disclosed
EP-1453803-A2 TETRAHYDROCARBOZOLE DERIVATIVES AS LIGANDS FOR G-PROTEIN COUPLED RECEPTORS (GPCR) Zentaris GmbH (DE) 2004-09-08 EP disclosed
US-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2003-12-18 US disclosed
WO-2003051837-A2 TETRAHYDROCARBOZOLE DERIVATIVES AS LIGANDS FOR G-PROTEIN COUPLED RECEPTORS (GPCR) ZENTARIS GMBH (DE) 2003-06-26 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 (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-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) GPR4, GPR88, GPR35 KMT2A 3412/4885MEN1 2877/4885ALDH1A1 4522/4885

“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.