SCHEMBL18385560

SCHEMBL18385560

CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccc9c(c8)C(C)(C)c8ccccc8-9)cc7n(-c7cccc(-c8cc(-c9ccccc9)nc(-n9c%10cc(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccc%12c(c%11)C(C)(C)c%11ccccc%11-%12)ccc%10c%10ccc(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccc%12c(c%11)C(C)(C)c%11ccccc%11-%12)cc%109)n8)c7)c6c5)ccc43)cc21

nearest known ligand 0.30

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL18385549 1.00 KDM4E (0.30) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385566 1.00 KDM4E (0.30) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385542 0.97 KDM4E (0.31) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385435 0.97 KDM4E (0.31) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385444 0.97 KDM4E (0.31) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385453 0.97 KDM4E (0.31) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385460 0.97 KDM4E (0.31) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385535 0.97 KDM4E (0.31) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL17879006 0.96 KDM4E (0.33) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL18385187 0.96 NPY5R (0.30) KDM4EALDH1A1HPGDTSHRMAPK1

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-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-19 — — US disclosed
US-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-19 — — 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-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE CD99, BMI1, ETV6 KDM4E 255/4885ALDH1A1 601/4885HPGD 3186/4885

“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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