SCHEMBL9909802

SCHEMBL9909802

Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(NC(=O)CCCCCCCCCCS)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 11/20 0.51
▸ HDAC3 O15379 10/20 0.51
▸ HDAC2 Q92769 10/20 0.51
▸ HDAC10 Q969S8 10/20 0.51
▸ HDAC9 Q9UKV0 9/20 0.51
▸ HDAC11 Q96DB2 9/20 0.51
▸ HDAC8 Q9BY41 9/20 0.51
▸ HDAC6 Q9UBN7 9/20 0.51
▸ HDAC4 P56524 8/20 0.51
▸ HDAC7 Q8WUI4 8/20 0.51
▸ HDAC5 Q9UQL6 8/20 0.51
▸ NCOR2 Q9Y618 1/20 0.48
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ TOP1 P11387 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ CYCS P99999 2/20 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
SCHEMBL9909807 0.91 ALDH1A1 (0.50) HDAC1HDAC3HDAC2HDAC10HDAC9
SCHEMBL9910535 0.80 ABCG2 (0.55) ABCG2TOP1LMNAALDH1A1CYCS
SCHEMBL9287004 0.77 TOP1 (0.53) HDAC1HDAC3HDAC2HDAC10HDAC9
SCHEMBL8572426 0.76 TOP1 (0.53) ABCG2TOP1CYCS
SCHEMBL16923748 0.74 ALDH1A1 (0.55) ABCG2TOP1ALDH1A1GAACYCS
SCHEMBL8994447 0.74 TOP1 (0.60) ABCG2TOP1ALDH1A1CYCS
SCHEMBL1974241 0.74 TOP1 (0.68) ABCG2TOP1LMNAALDH1A1GAA
SCHEMBL242168 0.74 TERT (0.62) ABCG2TOP1CYCS
SCHEMBL29693624 0.74 TERT (0.62) ABCG2TOP1CYCS
SCHEMBL25407804 0.72 TERT (0.65) ABCG2TOP1CYCS

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-8192917-B2 Material for multiphoton fluorescence microscope and multiphoton fluorescence microscope RICOH COMPANY, LTD. (JP) 2012-06-05 — — US disclosed
US-20090323508-A1 PHOTOSENSITIZED COMPOSITE MATERIAL, THREE-DIMENSIONAL MEMORY MATERIAL AND RECORDING MEDIUM, OPTICAL POWER LIMITING MATERIAL AND ELEMENT, AND PHOTOCURING MATERIAL AND STEREOLITHOGRAPHY SYSTEM, AND FLUORESCENT MATERIAL FOR MULTIPHOTON FLUORESCENCE MICROSCOPE AND MULTIPHOTON FLUORESCENCE MICROSCOPE RICOH COMPANY, LTD. (JP) 2009-12-31 — — 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-20090323508-A1 PHOTOSENSITIZED COMPOSITE MATERIAL, THREE-DIMENSIONAL MEMORY MATERIAL AND RECORDING MEDIUM, OPTICAL POWER LIMITING MATERIAL AND ELEMENT, AND PHOTOCURING MATERIAL AND STEREOLITHOGRAPHY SYSTEM, AND FLUORESCENT MATERIAL FOR MULTIPHOTON FLUORESCENCE MICROSCOPE AND MULTIPHOTON FLUORESCENCE MICROSCOPE HTR3D, ORAI3, GRIN3A HDAC1 2236/4885HDAC3 2540/4885HDAC2 2822/4885

“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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