SCHEMBL213222

SCHEMBL213222

CCC(c1ccc(O)c(O)c1C)C(CC)c1ccc(O)c(O)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 3/20 0.40
LMNA P02545 1/20 0.40
ESR1 P03372 1/20 0.40
CYP1A2 P05177 1/20 0.40
PGR P06401 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
AR P10275 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CHRM1 P11229 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
DRD1 P21728 1/20 0.40
TBXA2R P21731 1/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
CYP2C19 P33261 1/20 0.40
OPRM1 P35372 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
SCHEMBL15011592 0.77 LMNA (0.50) ADRA1ALMNACYP1A2CYP3A4CHRM1
SCHEMBL7145434 0.75 ADRA2A (0.61) ADRA1ALMNACYP3A4ADORA3MAPT
SCHEMBL272404 0.73 BCHE (0.46) ADRA1AHKDC1TSHRADRA2AADRA2B
SCHEMBL1461292 0.71 ADRA2A (0.68) ADRA1ACYP1A2CYP3A4ADORA3CYP2D6
SCHEMBL9767993 0.71 ADRA2A (0.68) ADRA1ACYP1A2CYP3A4ADORA3CYP2D6
SCHEMBL22432695 0.71 TYR (0.41) ADRA1ALMNAPGRMAPTALOX15
SCHEMBL31290749 0.70 TRPA1 (0.46) LMNAESR1MAPTALOX15TDP1
SCHEMBL3708636 0.70 TRPA1 (0.46) LMNAESR1MAPTALOX15TDP1
SCHEMBL29278698 0.70 ADRA2A (0.66) ADRA1ACYP1A2CYP3A4ADORA3CYP2D6
SCHEMBL2976451 0.70 ADRB2 (0.46) ADRA1ALMNAALOX15TSHRADRA2A

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 ADRA1A 4138/4885LMNA 2090/4885ESR1 4141/4885

“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.