SCHEMBL21102480

SCHEMBL21102480

Cc1c(N2CN(c3ccccc3)c3ccccc32)cccc1N1c2ccccc2N(C)[C@@H]1C

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ CYP17A1 P05093 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ BRD4 O60885 1/20 0.31
▸ HTR1A P08908 1/20 0.30
▸ HTR7 P34969 1/20 0.30
▸ HTR2B P41595 1/20 0.30
▸ TMEM97 Q5BJF2 1/20 0.30
▸ SIGMAR1 Q99720 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ ATM Q13315 1/20 0.30

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
SCHEMBL16772211 0.86 KDM4E (0.36) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16420322 0.82 KDM4E (0.47) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16424290 0.76 KDM4E (0.31) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16769702 0.75 KDM4E (0.41) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16420329 0.75 KDM4E (0.41) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL12092106 0.75 ALDH1A1 (0.43) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16421536 0.75 ALDH1A1 (0.43) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL24398363 0.74 GAA (0.44) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16711487 0.74 GAA (0.44) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL11941264 0.74 GAA (0.44) KDM4EALDH1A1GAAHPGDALOX12

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-11233204-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2022-01-25 — — US disclosed
US-20190189938-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2019-06-20 — — 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 (2 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-11233204-B2 Organic electroluminescent materials and devices LEF1, MLX, OCIAD1 KDM4E 1840/4885ALDH1A1 742/4885GAA 3925/4885
US-20190189938-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LEF1, MLX, OCIAD1 KDM4E 1840/4885ALDH1A1 742/4885GAA 3925/4885

“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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