SCHEMBL5532702

SCHEMBL5532702

OCC(O)COc1ccccc1C(c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.57
KDM4E B2RXH2 2/20 0.57
AGTR1 P30556 1/20 0.57
LMNA P02545 1/20 0.57
MEN1 O00255 1/20 0.54
CYP2C19 P33261 1/20 0.54
KMT2A Q03164 1/20 0.54
ALOX15 P16050 1/20 0.42
ABCB1 P08183 10/20 0.42
ADRB2 P07550 2/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40

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
SCHEMBL6241172 0.81 DRD2 (0.41) CYP1A2LMNAMEN1KMT2AABCB1
SCHEMBL26326254 0.80 CYP1A2 (0.81) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL12040803 0.80 CYP1A2 (0.65) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL15999373 0.80 CYP1A2 (0.65) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL15999372 0.80 CYP1A2 (0.65) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL21903451 0.78 ALDH1A1 (0.47) LMNAMEN1KMT2AADRB2
SCHEMBL15677167 0.76 CYP1A2 (0.59) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL20356701 0.76 CYP1A2 (0.59) CYP1A2KDM4EAGTR1LMNAMEN1
Guaietolin SCHEMBL2108931 0.76 CYP1A2 (0.74) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL11016998 0.76 CYSLTR2 (0.45) CYP1A2AGTR1LMNAMEN1KMT2A

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
WO-2023095615-A1 EPOXY RESIN COMPOSITION, CURED PRODUCT THEREOF, AND LAMINATE DIC株式会社 2023-06-01 WO disclosed
US-20070042030-A1 Preparation for the application of agents in mini-droplets IDEA AG (DE) 2007-02-22 US disclosed
US-6165500-A Preparation for the application of agents in mini-droplets IDEA AG (DE) 2000-12-26 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-20070042030-A1 Preparation for the application of agents in mini-droplets FABP4, NPC1L1, LIPA CYP1A2 3242/4885KDM4E 4445/4885AGTR1 1241/4885

“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.