SCHEMBL20706325

SCHEMBL20706325

C=C(SCCC(C)(C)C)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.35
EGFR P00533 2/20 0.33
MAOA P21397 4/20 0.32
MAOB P27338 4/20 0.32
ATM Q13315 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
XBP1 P17861 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL23837678 0.79 CES2 (0.38) EGFRMAOAMAOBATMMAPT
SCHEMBL17236360 0.78 KMT2A (0.46) RIPK1NPC1RAB9APOLBTDP1
SCHEMBL19391886 0.76 ALDH1A1 (0.49) NPC1RAB9AMAOBATMMAPT
SCHEMBL1272033 0.74 ALDH1A1 (0.44) POLBNPSR1ALDH1A1
SCHEMBL19677301 0.74 HDAC3 (0.46) EGFRMAOAMAOBATMMAPT
SCHEMBL19391813 0.71 SMN1; SMN2 (0.37) NPC1RAB9AATMMAPTMEN1
SCHEMBL5039116 0.71 MAOA (0.44) RIPK1POLBMAOAMAOBMAPT
SCHEMBL19474336 0.70 ALDH1A1 (0.37) ATMTDP1MAPTLMNAXBP1
SCHEMBL12227656 0.69 KMT2A (0.41) POLBEGFRTDP1MAPTMEN1
SCHEMBL27390903 0.67 AKT1 (0.39) RAB9APOLBMAOAMAOBMAPT

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-10196418-B2 Phosphorous protecting groups and methods of preparation and use thereof AGILENT TECHNOLOGIES, INC. (US) 2019-02-05 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-10196418-B2 Phosphorous protecting groups and methods of preparation and use thereof POLN, POLRMT, NUDT21 RIPK1 3137/4885NPC1 4041/4885RAB9A 3121/4885

“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.