SCHEMBL18021726

SCHEMBL18021726

Cc1cc(=O)[nH]c2cc(C(C)(C)C)ccc12

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.59
▸ GLA P06280 3/20 0.59
▸ GAA P10253 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ HPGD P15428 2/20 0.59
▸ TP53 P04637 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ TNKS2 Q9H2K2 8/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ KIF11 P52732 4/20 0.54
▸ TNKS O95271 1/20 0.48
▸ LMNA P02545 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL2056354 0.86 LMNA (0.59) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL13245001 0.83 ALDH1A1 (0.54) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL18021723 0.80 AR (0.63) KIF11
SCHEMBL31369133 0.79 KIF11 (0.65) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL31369143 0.79 KIF11 (0.65) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL2606005 0.78 KIF11 (0.81) ALDH1A1HPGDKIF11MAPTHSD17B10
SCHEMBL29539315 0.78 KIF11 (0.81) ALDH1A1HPGDKIF11MAPTHSD17B10
SCHEMBL2795205 0.77 KDM4E (0.67) KDM4EGLAGAAALDH1A1HPGD
Bromide SCHEMBL30567841 0.77 KIF11 (0.78) ALDH1A1HPGDKIF11MAPTHSD17B10
SCHEMBL13244957 0.75 KIF11 (0.54) KDM4EALDH1A1HPGDSMN1; SMN2TNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10241116-B2 Dual-sensitizer-containing luminescent compounds, conjugates, and uses thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-03-26 — — US disclosed
US-20170016907-A1 DUAL-SENSITIZER-CONTAINING LUMINESCENT COMPOUNDS, CONJUGATES, AND USES THEREOF RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2017-01-19 — — US disclosed
US-20170016907-A1 DUAL-SENSITIZER-CONTAINING LUMINESCENT COMPOUNDS, CONJUGATES, AND USES THEREOF RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2017-01-19 — — US disclosed
US-9415111-B2 Dual-sensitizer-containing luminescent compounds, conjugates, and uses thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-08-16 — — 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-20170016907-A1 DUAL-SENSITIZER-CONTAINING LUMINESCENT COMPOUNDS, CONJUGATES, AND USES THEREOF DYRK4, DYRK2, DYRK3 KDM4E 2347/4885GLA 1328/4885GAA 473/4885
US-10241116-B2 Dual-sensitizer-containing luminescent compounds, conjugates, and uses thereof DYRK4, DYRK2, DYRK3 KDM4E 2347/4885GLA 1328/4885GAA 473/4885

“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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