SCHEMBL278719

SCHEMBL278719

CC(C)(C)Oc1c2ccccc2cc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 1/20 0.44
▸ KIF11 P52732 1/20 0.41
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40
▸ TUBA3C P0DPH7 1/20 0.40
▸ TUBA1B P68363 1/20 0.40
▸ TUBA4A P68366 1/20 0.40
▸ TUBB4B P68371 1/20 0.40
▸ TUBB3 Q13509 1/20 0.40
▸ TUBB2A Q13885 1/20 0.40
▸ TUBB8 Q3ZCM7 1/20 0.40
▸ TUBA3E Q6PEY2 1/20 0.40
▸ TUBA1A Q71U36 1/20 0.40
▸ TUBA1C Q9BQE3 1/20 0.40
▸ TUBB6 Q9BUF5 1/20 0.40
▸ TUBB2B Q9BVA1 1/20 0.40
▸ TUBB1 Q9H4B7 1/20 0.40
▸ ALDH1A1 P00352 7/20 0.39
▸ HSD17B10 Q99714 4/20 0.39
▸ HIF1A Q16665 1/20 0.39

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
SCHEMBL29919640 0.84 ALDH1A1 (0.50) KIF11ALDH1A1HSD17B10CYP1A2CYP2A6
SCHEMBL11886723 0.84 ALDH1A1 (0.50) KIF11ALDH1A1HSD17B10CYP1A2CYP2A6
SCHEMBL27902827 0.80 MAPK1 (0.47) GPR84TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3824978 0.78 MAPT (0.46) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL599396 0.75 ALDH1A1 (0.67) GPR84TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL30949367 0.75 ALDH1A1 (0.67) GPR84TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2357775 0.74 GPR84 (0.52) GPR84TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL14297093 0.74 ALDH1A1 (0.37) KIF11ALDH1A1HSD17B10CYP1A2CYP2A6
SCHEMBL28373989 0.74 ALDH1A1 (0.45) KIF11ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL15914806 0.72 CYP1A2 (0.52) KIF11ALDH1A1HSD17B10HIF1ACYP1B1

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
CN-113166043-A Electrolyte for sulfur-based magnesium battery 富士胶片和光纯药株式会社 2021-07-23 — — CN disclosed
US-8133984-B2 Oligonucleotides comprising signalling pairs and hydrophobic nucleotides, stemless beacons, for detection of nucleic acids, methylation status and mutants of nucleic acids PENTABASE APS (DK) 2012-03-13 — — US disclosed
US-8133984-B2 Oligonucleotides comprising signalling pairs and hydrophobic nucleotides, stemless beacons, for detection of nucleic acids, methylation status and mutants of nucleic acids PENTABASE APS (DK) 2012-03-13 — — US disclosed
US-20100121056-A1 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR HUMAN GENETIC SIGNATURES PTY. LTD. (AU) 2010-05-13 — — US disclosed
US-20100121056-A1 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR HUMAN GENETIC SIGNATURES PTY. LTD. (AU) 2010-05-13 — — US disclosed
US-20100068704-A1 OLIGONUCLEOTIDES COMPRISING SIGNALLING PAIRS AND HYDROPHOBIC NUCLEOTIDES, STEMLESS BEACONS, FOR DETECTION OF NUCLEIC ACIDS, METHYLATION STATUS AND MUTANTS OF NUCLEIC ACIDS PENTABASE APS (DK) 2010-03-18 — — US disclosed
US-20100068704-A1 OLIGONUCLEOTIDES COMPRISING SIGNALLING PAIRS AND HYDROPHOBIC NUCLEOTIDES, STEMLESS BEACONS, FOR DETECTION OF NUCLEIC ACIDS, METHYLATION STATUS AND MUTANTS OF NUCLEIC ACIDS PENTABASE APS (DK) 2010-03-18 — — 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 (2 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-20100068704-A1 OLIGONUCLEOTIDES COMPRISING SIGNALLING PAIRS AND HYDROPHOBIC NUCLEOTIDES, STEMLESS BEACONS, FOR DETECTION OF NUCLEIC ACIDS, METHYLATION STATUS AND MUTANTS OF NUCLEIC ACIDS DNMT1, DNMT3A, DNMT3L GPR84 1827/4885KIF11 3471/4885TUBB4A 2873/4885
US-20100121056-A1 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR POLRMT, POLN, RNASE1 GPR84 4079/4885KIF11 3655/4885TUBB4A 1266/4885

“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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