SCHEMBL14520994

SCHEMBL14520994

Cc1cccc(N(c2ccc(-c3ccc(N(c4cccc(C)c4)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)cc3)cc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 12/20 0.42
▸ HSD17B1 P14061 2/20 0.35
▸ HSD17B2 P37059 2/20 0.35
▸ PGR P06401 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ ENPP3 O14638 1/20 0.31

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
SCHEMBL14420683 0.96 PDK2 (0.40) PDK2HSD17B1HSD17B2PGRLMNA
SCHEMBL14416486 0.96 PDK2 (0.40) PDK2HSD17B1HSD17B2PGRLMNA
SCHEMBL17153684 0.95 PDK2 (0.47) PDK2HSD17B1HSD17B2PGRENPP3
SCHEMBL29512073 0.94 PDK2 (0.41) PDK2HSD17B1HSD17B2LMNANPSR1
SCHEMBL29351177 0.94 PDK2 (0.41) PDK2HSD17B1HSD17B2LMNANPSR1
SCHEMBL15473730 0.94 PDK2 (0.41) PDK2HSD17B1HSD17B2LMNANPSR1
SCHEMBL17070108 0.94 PDK2 (0.41) PDK2HSD17B1HSD17B2LMNANPSR1
SCHEMBL2431947 0.94 PDK2 (0.41) PDK2HSD17B1HSD17B2LMNANPSR1
SCHEMBL18906597 0.94 PDK2 (0.41) PDK2HSD17B1HSD17B2LMNANPSR1
SCHEMBL14520992 0.94 PDK2 (0.40) PDK2HSD17B1HSD17B2LMNANPSR1

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-20070077450-A1 Conjugated compounds containing triarylamine structural elements, and their use LUMINESCENCE TECHNOLOGY CORP. (TW) 2007-04-05 — — US disclosed
US-20070077450-A1 Conjugated compounds containing triarylamine structural elements, and their use LUMINESCENCE TECHNOLOGY CORP. (TW) 2007-04-05 — — 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-20070077450-A1 Conjugated compounds containing triarylamine structural elements, and their use TIMM9, DCX, INMT PDK2 3526/4885HSD17B1 2635/4885HSD17B2 1804/4885

“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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