SCHEMBL213221

SCHEMBL213221

CCC(c1ccc(O)c(CO)c1)C(CC)c1ccc(O)c(CO)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.54
ADRB2 P07550 9/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2D6 P10635 2/20 0.51
TSHR P16473 1/20 0.51
NFKB1 P19838 1/20 0.51
HIF1A Q16665 1/20 0.51
ADRB1 P08588 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
ALOX15 P16050 2/20 0.50
LMNA P02545 1/20 0.50
ESR1 P03372 1/20 0.50
PGR P06401 1/20 0.50
CHRM2 P08172 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
AR P10275 1/20 0.50
MAPT P10636 1/20 0.50
CHRM1 P11229 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL29508269 0.85 ADRB2 (0.51) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL19236388 0.83 ADRB2 (0.62) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL14291852 0.83 ADRB2 (0.62) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL112701 0.83 PKM (0.61) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL15394713 0.80 ADRB2 (0.51) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL2485343 0.80 PRKCI (0.59) SHBGCYP1A2CYP2D6TDP1ALOX15
SCHEMBL10215349 0.80 ADRB2 (0.54) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL1145899 0.79 ADRB2 (0.54) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL19017735 0.79 ADRB2 (0.47) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL22607306 0.78 ADRB2 (0.57) ADRB2CYP1A2CYP2D6TSHRNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE43067-E1 Method for producing new polynuclear poly(formylphenol) HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2012-01-03 US disclosed
US-7750190-B2 reacting hexamethylene tetramine in presence of acid; industrial scale; photoresists HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-07-06 US disclosed
US-20090182175-A1 METHOD FOR PRODUCING NEW POLYNUCLEAR POLY(FORMYLPHENOL) HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2009-07-16 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-20090182175-A1 METHOD FOR PRODUCING NEW POLYNUCLEAR POLY(FORMYLPHENOL) PCBP1, FPR2, PNKP SHBG 3146/4885ADRB2 2678/4885CYP1A2 1194/4885

“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.