SCHEMBL16815265

SCHEMBL16815265

Nc1ccc(NC(=O)NCCCCCC(=O)O)cc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 8/20 0.63
▸ RAB9A P51151 1/20 0.59
▸ PRMT1 Q99873 1/20 0.49
▸ MAPK1 P28482 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ EPHX2 P34913 2/20 0.44
▸ S1PR1 P21453 1/20 0.44
▸ HDAC1 Q13547 2/20 0.43
▸ HDAC8 Q9BY41 2/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.43
▸ HDAC3 O15379 1/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ HDAC7 Q8WUI4 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC10 Q969S8 1/20 0.43
▸ HDAC11 Q96DB2 1/20 0.43
▸ HDAC9 Q9UKV0 1/20 0.43
▸ HDAC5 Q9UQL6 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
SCHEMBL16817792 0.79 ALDH1A1 (0.56) ALDH1A1HDAC1HDAC8HDAC6HDAC3
SCHEMBL31372373 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL31372218 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL31372224 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL23646221 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL23646267 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL23646198 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL23646271 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL31372293 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA
SCHEMBL15741892 0.78 EPHX1 (0.66) EPHX1RAB9APRMT1MAPK1LMNA

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
EP-2886542-B1 Marker dyes for UV and short-wave excitation with high Stokes shift on the basis of benzoxazoles DYOMICS GMBH (DE) 2018-04-18 — — EP disclosed
US-9453010-B2 Marker dyes for UV and short wave excitation with high stokes shift based on benzoxazoles DYOMICS GMBH (DE) 2016-09-27 — — US disclosed
US-20150175591-A1 MARKER DYES FOR UV AND SHORT WAVE EXCITATION WITH HIGH STOKES SHIFT BASED ON BENZOXAZOLES DYOMICS GMBH (DE) 2015-06-25 — — US disclosed
EP-2886542-A1 Marker dyes for UV and short-wave excitation with high Stokes shift on the basis of benzoxazoles Dyomics GmbH (DE) 2015-06-24 — — EP 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-20150175591-A1 MARKER DYES FOR UV AND SHORT WAVE EXCITATION WITH HIGH STOKES SHIFT BASED ON BENZOXAZOLES NR2E3, H1-10, NR0B1 EPHX1 2266/4885RAB9A 4678/4885PRMT1 2752/4885

“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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