SCHEMBL5058248

SCHEMBL5058248

[CH2]C(c1ccco1)c1ccco1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
POLB P06746 6/20 0.44
PKM P14618 3/20 0.44
PTPN7 P35236 3/20 0.44
BLM P54132 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
PTPN1 P18031 1/20 0.44
ESR2 Q92731 1/20 0.44
ALDH1A1 P00352 7/20 0.42
HSD17B10 Q99714 5/20 0.42
MEN1 O00255 5/20 0.42
MAPT P10636 5/20 0.42
KDM4E B2RXH2 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
HPGD P15428 4/20 0.40
AGTR1 P30556 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 2/20 0.39

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
SCHEMBL3817995 0.85 CYP2C19 (0.47) KMT2APOLBPKMPTPN7BLM
SCHEMBL11452535 0.78
SCHEMBL402343 0.78
SCHEMBL1706005 0.78
SCHEMBL4982361 0.75 KMT2A (0.48) KMT2APOLBPKMPTPN7BLM
SCHEMBL11151822 0.73 KMT2A (0.58) KMT2APOLBPKMPTPN7BLM
SCHEMBL15272327 0.73 KMT2A (0.58) KMT2APOLBPKMPTPN7BLM
SCHEMBL15272598 0.73 KMT2A (0.58) KMT2APOLBPKMPTPN7BLM
SCHEMBL8014934 0.72
SCHEMBL3678578 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420684-B2 imidazole derivatives; Alzheimer's Disease, Down syndrome, Huntington's Disease; hypotensive agents; sleeping/eating disorders, anxiolytic agents, antidepressants, antiepileptic agents; drug abuse/withdrawl; 4-Cyclopropylimino-5-(3,4-dihydro-2H-pyran-2-yl)-1-(3-imidazol-1-yl-propyl)-imidazolidin-2-one PROBIODRUG AG (DE) 2013-04-16 US disclosed
US-20080221086-A1 Novel Inhibitors of Glutaminyl Cyclase PROBIODRUG AG (DE) 2008-09-11 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-20080221086-A1 Novel Inhibitors of Glutaminyl Cyclase GLS, GLS2, GLUL KMT2A 3747/4885POLB 1791/4885PKM 2470/4885

“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.