SCHEMBL2199107

SCHEMBL2199107

CC(c1ccc(O)cc1)P(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.52
ESR2 Q92731 9/20 0.52
PDCD1 Q15116 1/20 0.52
CD274 Q9NZQ7 1/20 0.52
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
MMP2 P08253 1/20 0.45
PGK1 P00558 2/20 0.43
PGK2 P07205 2/20 0.43
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CHRM1 P11229 1/20 0.41

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
SCHEMBL3883015 0.82 CA12 (0.48) CA12CA1MMP2PGK1PGK2
SCHEMBL27323386 0.81 HSD17B10 (0.44) ESR1ESR2PDCD1CD274CYP1A2
SCHEMBL2637390 0.80 PGK1 (0.41) PGK1PGK2MAPTMEN1KMT2A
SCHEMBL232549 0.79 SRC (0.60) PGK1PGK2SRC
SCHEMBL11030369 0.78 ESR1 (0.48) ESR1ESR2PDCD1CD274CA12
SCHEMBL28543474 0.77 SRC (0.58) PGK1PGK2SRC
SCHEMBL5936840 0.76 SRC (0.62) ESR1ESR2PDCD1CD274CA12
SCHEMBL10454829 0.76 ACP3 (0.59) ESR1ESR2PDCD1CD274CA12
SCHEMBL9789602 0.76 HPGD (0.49) PGK1PGK2LMNACYP3A4MAPT
SCHEMBL4881249 0.75 ALDH1A1 (0.42) PGK1PGK2TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680263-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2014-03-25 US disclosed
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2011-07-14 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-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST ESR1 3800/4885ESR2 4637/4885PDCD1 2956/4885

“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.