SCHEMBL14815564

SCHEMBL14815564

CC(C)(O)C1CCCc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
MAPK1 P28482 1/20 0.44
MAPK14 Q16539 1/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 3/20 0.42
HTT P42858 3/20 0.42
XBP1 P17861 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
PDPK1 O15530 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL17236390 0.89 PDPK1 (0.47) IDO1PDPK1
SCHEMBL20706323 0.85 IDO1 (0.49) IDO1MAPK1MAPK14LMNAALDH1A1
SCHEMBL3394130 0.83 PDPK1 (0.44) IDO1MAPK1MAPK14LMNAALDH1A1
SCHEMBL22808450 0.82 IDO1 (0.50) IDO1MAPK1MAPK14LMNAALDH1A1
SCHEMBL9515277 0.79 IDO1 (0.44) IDO1MAPK1MAPK14LMNAALDH1A1
SCHEMBL19117311 0.79 IDO1 (0.44) IDO1MAPK1MAPK14LMNAALDH1A1
SCHEMBL9004030 0.78 IDO1 (0.49) IDO1LMNAALDH1A1HTT
SCHEMBL10836441 0.77 IDO1 (0.45) IDO1ALDH1A1HTTXBP1
SCHEMBL5478312 0.77 IDO1 (0.39) IDO1MAPK1MAPK14LMNAALDH1A1
SCHEMBL2999014 0.76 CYP19A1 (0.42) IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11584773-B2 Phosphorous protecting groups and methods of preparation and use thereof AGILENT TECHNOLOGIES, INC. (US) 2023-02-21 US disclosed
US-20220002334-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF COLORADO BOULDER 2022-01-06 US disclosed
US-20190194242-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF COLORADO BOULDER 2019-06-27 US disclosed
US-10196418-B2 Phosphorous protecting groups and methods of preparation and use thereof AGILENT TECHNOLOGIES, INC. (US) 2019-02-05 US disclosed
US-20150315227-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF COLORADO BOULDER 2015-11-05 US disclosed
US-8574817-B2 Positive resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-11-05 US disclosed
US-20130084529-A1 POSITIVE RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-04-04 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 (5 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-20190194242-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF POLN, POLRMT, NUDT21 IDO1 3979/4885MAPK1 2432/4885MAPK14 2625/4885
US-10196418-B2 Phosphorous protecting groups and methods of preparation and use thereof POLN, POLRMT, NUDT21 IDO1 3979/4885MAPK1 2432/4885MAPK14 2625/4885
US-20220002334-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF POLN, POLRMT, NUDT21 IDO1 3979/4885MAPK1 2432/4885MAPK14 2625/4885
US-20150315227-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF POLN, POLRMT, NUDT21 IDO1 3979/4885MAPK1 2432/4885MAPK14 2625/4885
US-11584773-B2 Phosphorous protecting groups and methods of preparation and use thereof POLN, POLRMT, NUDT21 IDO1 3979/4885MAPK1 2432/4885MAPK14 2625/4885

“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.