SCHEMBL4173020

SCHEMBL4173020

CC1=Cc2cccc3cccc(c23)N1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.55
▸ MEN1 O00255 7/20 0.55
▸ NSD2 O96028 4/20 0.49
▸ ALDH1A1 P00352 9/20 0.43
▸ KDM4E B2RXH2 7/20 0.43
▸ HPGD P15428 6/20 0.43
▸ MAPT P10636 6/20 0.43
▸ GAA P10253 5/20 0.43
▸ HSD17B10 Q99714 4/20 0.43
▸ HTT P42858 2/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ CASP7 P55210 1/20 0.43
▸ APP P05067 1/20 0.41
▸ SNCA P37840 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ POLB P06746 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MAPK1 P28482 1/20 0.34
▸ CYP1A2 P05177 2/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL4148679 0.75 KMT2A (0.44) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL11873223 0.73 KMT2A (0.42) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL27427955 0.71 ALDH1A1 (0.51) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL12258293 0.70 KMT2A (0.61) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL11784099 0.70 KMT2A (0.36) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL11786868 0.69 KMT2A (0.41) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL1773296 0.67 NSD2 (0.46) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL4173015 0.65 NSD2 (1.00) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL12258292 0.64 ALDH1A1 (0.59) KMT2AMEN1NSD2ALDH1A1KDM4E
SCHEMBL24073133 0.63 SMN1; SMN2 (0.62) KMT2AMEN1NSD2ALDH1A1KDM4E

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-8710088-B2 Pharmaceutical and diagnostic compositions for use in the treatment and diagnosis of neurodegenerative diseases or amyloid diseases MAX-DELBRUCK-CENTRUM FUR MOLEKULARE MEDIZIN (DE) 2014-04-29 — — US disclosed
US-20090117040-A1 Novel pharmaceutical and diagnostic compositions for use in the treatment and diagnosis of neurodegenerative diseases or amyloid diseases MAX-DELBRUG-CENTRUM FUR MOLEKULARE MEDIZIN (DE) 2009-05-07 — — US disclosed
EP-0406812-B1 Process for the preparation of NiNi-dialkyl-1,8-naphthalene diamine HERCULES INC (US) 1995-02-15 — — EP disclosed
US-5097029-A Hydrolysis, alkylation, intermediates for azo dyes HERCULES INCORPORATED (US) 1992-03-17 — — US disclosed
EP-0406812-A2 Process for the preparation of NiNi-dialkyl-1,8-naphthalene diamine HERCULES INCORPORATED (US) 1991-01-09 — — 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-20090117040-A1 Novel pharmaceutical and diagnostic compositions for use in the treatment and diagnosis of neurodegenerative diseases or amyloid diseases APP, PSEN2, PSEN1 KMT2A 4715/4885MEN1 1020/4885NSD2 4678/4885

“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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