SCHEMBL20306691

SCHEMBL20306691

c1ccc(-c2ccc3ccc(-c4ccc5c(c4)[nH]c4ccccc45)cc3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 2/20 0.52
▸ CCND1 P24385 2/20 0.52
▸ AHR P35869 1/20 0.52
▸ HTR2B P41595 1/20 0.49
▸ HTR5A P47898 1/20 0.49
▸ TNKS2 Q9H2K2 1/20 0.49
▸ KIF11 P52732 8/20 0.49
▸ ESR1 P03372 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.48
▸ GPR3 P46089 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ FEN1 P39748 1/20 0.45
▸ FGFR1 P11362 1/20 0.45
▸ JAK2 O60674 1/20 0.44
▸ GABRP O00591 1/20 0.43
▸ GABRD O14764 1/20 0.43
▸ GABRA1 P14867 1/20 0.43
▸ GABRB1 P18505 1/20 0.43
▸ GABRG2 P18507 1/20 0.43

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
Carbazole SCHEMBL28221373 0.91 AHR (0.61) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL20290655 0.91 AHR (0.61) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL29724221 0.91 AHR (0.61) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL1900394 0.91 AHR (0.61) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL30959744 0.91 AHR (0.61) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL24037177 0.90 AHR (0.57) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL20291012 0.89 AHR (0.55) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL20290997 0.87 AHR (0.57) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL20290634 0.87 AHR (0.57) CDK4CCND1AHRHTR2BHTR5A
SCHEMBL5999272 0.85 AHR (0.70) CDK4CCND1AHRKIF11ALDH1A1

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-10005787-B2 Highly photo-stable bis-triazole fluorophores NITTO DENKO CORPORATION (JP) 2018-06-26 — — 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-10005787-B2 Highly photo-stable bis-triazole fluorophores CBR3, TPD52L2, TNS4 CDK4 33/4885CCND1 323/4885AHR 363/4885

“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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