SCHEMBL21867260

SCHEMBL21867260

O=C(CCCCN1C(=O)c2ccc3c4ccc5c6ccc7c8ccc9c%10ccc%11c%12ccc%13c%14c(ccc(c%15ccc(c%16ccc(c%17ccc(c%18ccc(c%19ccc(c2c3%19)C1=O)c4c5%18)c6c7%17)c8c9%16)c%10c%11%15)c%14%12)C(=O)N(CCCCC(=O)NS(=O)(=O)C(F)(F)F)C%13=O)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 12/20 0.46
▸ HDAC1 Q13547 12/20 0.46
▸ HDAC6 Q9UBN7 12/20 0.46
▸ HDAC3 O15379 11/20 0.46
▸ HDAC11 Q96DB2 11/20 0.46
▸ HDAC7 Q8WUI4 9/20 0.46
▸ HDAC2 Q92769 9/20 0.46
▸ HDAC10 Q969S8 9/20 0.46
▸ HDAC5 Q9UQL6 9/20 0.46
▸ HDAC4 P56524 8/20 0.46
▸ HDAC9 Q9UKV0 8/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ NCOR2 Q9Y618 4/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ STAT3 P40763 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ HTT P42858 2/20 0.45

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
SCHEMBL21867298 0.76 SMN1; SMN2 (0.45) HDAC8HDAC1HDAC6HDAC3HDAC11
SCHEMBL22018079 0.76 MEN1 (0.60) HDAC8HDAC1HDAC6HDAC3HDAC11
SCHEMBL21867107 0.75 MAPT (0.45) HDAC8HDAC1HDAC6HDAC3HDAC11
SCHEMBL22019037 0.74 SMN1; SMN2 (0.62) HDAC8HDAC1HDAC6HDAC3HDAC11
SCHEMBL14309279 0.71 KDM4E (0.86) ALDH1A1MEN1KMT2ASTAT3HIF1A
SCHEMBL15593453 0.71 MEN1 (0.49) ALDH1A1MEN1KMT2AKDM4EHTT
SCHEMBL24813700 0.70 STAT3 (0.57) HDAC8HDAC1HDAC6HDAC3HDAC11
SCHEMBL14302831 0.70 KDM4E (0.83) ALDH1A1MEN1KMT2ASTAT3HIF1A
SCHEMBL14303164 0.69 KDM4E (0.77) ALDH1A1MEN1KMT2ASTAT3HIF1A
SCHEMBL27501354 0.69 HDAC8 (0.70) HDAC8HDAC1HDAC6HDAC3HDAC11

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-20200115382-A1 CURABLE COMPOSITION, CURED FILM, OPTICAL FILTER, SOLID IMAGE PICKUP ELEMENT, IMAGE DISPLAY DEVICE, INFRARED SENSOR, DISPERSING AUXILIARY AGENT, DISPERSION, AND METHOD OF MANUFACTURING DISPERSION FUJIFILM CORPORATION (JP) 2020-04-16 — — 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 (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-20200115382-A1 CURABLE COMPOSITION, CURED FILM, OPTICAL FILTER, SOLID IMAGE PICKUP ELEMENT, IMAGE DISPLAY DEVICE, INFRARED SENSOR, DISPERSING AUXILIARY AGENT, DISPERSION, AND METHOD OF MANUFACTURING DISPERSION PRKG2, PRKD1, PRKG1 HDAC8 2178/4885HDAC1 1434/4885HDAC6 1148/4885

“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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