SCHEMBL6865348

SCHEMBL6865348

CCn1c(C(=O)c2cc3cc(OC)ccc3n2CC)cc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.56
GRIK2 Q13002 1/20 0.56
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
HSD17B10 Q99714 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CCR2 P41597 3/20 0.47
MTNR1A P48039 3/20 0.47
MTNR1B P49286 3/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 1/20 0.47
CNR2 P34972 2/20 0.46
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL6871064 0.94 KDM4E (0.57) GRIK1GRIK2KDM4EALDH1A1HPGD
SCHEMBL6867612 0.86 CCR2 (0.61) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL6867577 0.84 FLT3 (0.63) KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL6866879 0.84 PDGFRB (0.63)
SCHEMBL700814 0.83 KDM4E (0.67) GRIK1GRIK2KDM4EALDH1A1HPGD
SCHEMBL701976 0.75 CCR2 (0.69) ALDH1A1L3MBTL1CCR2POLB
SCHEMBL30067600 0.75 CCR2 (0.69) ALDH1A1L3MBTL1CCR2POLB
SCHEMBL18247515 0.75 CCR2 (0.64) GRIK1GRIK2KDM4EALDH1A1HPGD
SCHEMBL6865379 0.75 HDAC3 (0.66) KDM4EALDH1A1HPGDHSD17B10L3MBTL1
SCHEMBL30044340 0.74 CCR2 (0.58) ALDH1A1CCR2MTNR1AMTNR1BPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6812243-B2 AS TYROSINE KINASE INHIBITORS; FOR THERARPY OF TUMORS, ARTERIOSCLEROSIS, RESTENOSIS AFTER BALLOON ANGIOPLASTY, ARTHRITIS AND FIBROTIC DISEASES ZENTARIS AG (DE) 2004-11-02 US disclosed
US-20030008898-A1 Indole derivatives and their use for the treatment of malignant and other diseases based on pathological proliferation ZENTARIS AG (DE) 2003-01-09 US disclosed
US-6407102-B1 TYROSINE KINASE AND PLATELET-DERIVED GROWTH FACTOR INHIBITORS; ANTICARCINOGENIC, ANTITUMOR, ANTIARTHRITIC AND ANTIPROLIFERATIVE AGENTS; RESTENOSIS, ARTERIOSCLEROSIS ZENTARIS AG (DE) 2002-06-18 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 (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-20030008898-A1 Indole derivatives and their use for the treatment of malignant and other diseases based on pathological proliferation MKI67, IDO1, CCNI GRIK1 1358/4885GRIK2 2074/4885KDM4E 1497/4885

“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.