SCHEMBL25899409

SCHEMBL25899409

OBOc1cc(-c2ccccc2)cc(-c2ccc3c4ccccc4c4ccccc4c3c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.38
ABCB1 P08183 3/20 0.38
BCR P11274 3/20 0.38
ESR1 P03372 3/20 0.36
ESR2 Q92731 3/20 0.36
ALOX5 P09917 1/20 0.35
CYP1A1 P04798 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2E1 P05181 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2A6 P11509 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP4B1 P13584 1/20 0.34
CYP2B6 P20813 1/20 0.34
CYP3A5 P20815 1/20 0.34
CYP2A7 P20853 1/20 0.34
CYP3A7 P24462 1/20 0.34
CYP2F1 P24903 1/20 0.34

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
SCHEMBL27253078 0.89 ABL1 (0.36) ABL1ABCB1BCRESR1CYP1A1
SCHEMBL16659313 0.88 ABL1 (0.42) ABL1ABCB1BCRESR1ESR2
SCHEMBL27253075 0.87 PLAU (0.34) ABL1ABCB1BCRCYP1A1CYP1A2
SCHEMBL27253079 0.86 ESR1 (0.33) ABL1ABCB1BCRESR1ESR2
SCHEMBL27253077 0.86 ESR1 (0.33) ABL1ABCB1BCRESR1ESR2
SCHEMBL17808985 0.86 ALDH1A1 (0.39) ABL1ABCB1BCRESR1ESR2
SCHEMBL25899406 0.86 ALDH1A1 (0.39) ABL1ABCB1BCRESR1ESR2
SCHEMBL27253080 0.81 CYP1A1 (0.44) ABL1ABCB1BCRESR1CYP1A1
SCHEMBL25899354 0.81 ABL1 (0.41) ABL1ABCB1BCRESR1ESR2
SCHEMBL20431772 0.80 ALDH1A1 (0.45) ABL1ABCB1BCRESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230247899-A1 ORGANIC ELECTRONIC ELEMENT CONTAINING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREFOR DUK SAN NEOLUX CO., LTD. (KR) 2023-08-03 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-20230247899-A1 ORGANIC ELECTRONIC ELEMENT CONTAINING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREFOR SLC39A11, LEF1, SLC39A14 ABL1 3770/4885ABCB1 3472/4885BCR 2642/4885

“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.