SCHEMBL210420

SCHEMBL210420

Cc1cc(O)cc(CO)c1-c1c(C)cc(O)cc1CO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.44
MAOA P21397 2/20 0.44
CHRM1 P11229 1/20 0.44
ALOX15 P16050 1/20 0.44
TBXA2R P21731 1/20 0.44
ADRA1A P35348 1/20 0.44
HTR2B P41595 1/20 0.44
SHBG P04278 1/20 0.43
ACHE P22303 2/20 0.40
ALDH1A1 P00352 2/20 0.38
CYP19A1 P11511 1/20 0.36
MEN1 O00255 1/20 0.35
HSP90AA1 P07900 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
ESR2 Q92731 4/20 0.35
ESR1 P03372 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
BACE1 P56817 1/20 0.33

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
SCHEMBL11529244 0.83 CYP3A4 (0.42) CYP3A4MAOACHRM1ALOX15TBXA2R
SCHEMBL3468630 0.83 CYP3A4 (0.42) CYP3A4MAOACHRM1ALOX15TBXA2R
SCHEMBL15449429 0.83 SHBG (0.63) CYP3A4MAOACHRM1ALOX15TBXA2R
Methane SCHEMBL2220977 0.81 SHBG (0.61) CYP3A4MAOACHRM1ALOX15TBXA2R
Methane SCHEMBL27819850 0.81 SHBG (0.61) CYP3A4MAOACHRM1ALOX15TBXA2R
SCHEMBL24373534 0.79 CYP3A4 (0.62) CYP3A4MAOACHRM1ALOX15TBXA2R
SCHEMBL17328717 0.79 ACHE (0.43) CYP3A4MAOACHRM1ALOX15TBXA2R
SCHEMBL476694 0.78 CYP3A4 (0.58) CYP3A4MAOACHRM1ALOX15TBXA2R
SCHEMBL6244688 0.76 TYR (0.48) CYP3A4MAOAALOX15ALDH1A1MEN1
SCHEMBL12641067 0.75 CD274 (0.56) SHBGMEN1HSP90AA1KMT2AATM

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 CYP3A4 2598/4885MAOA 482/4885CHRM1 3007/4885

“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.