SCHEMBL3364355

SCHEMBL3364355

Cc1cc(O)c(C2CCCCC2)cc1C(C)c1cc(C2CCCCC2)c(O)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.39
BACE1 P56817 1/20 0.39
HSP90AA1 P07900 1/20 0.39
PSMB5 P28074 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 1/20 0.34
PTGDR2 Q9Y5Y4 3/20 0.33
PTGDR Q13258 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
NR1I2 O75469 1/20 0.31
KDM4B O94953 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31

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
SCHEMBL3181813 0.88 NUDT1 (0.40) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL278769 0.88 NUDT1 (0.40) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL29623069 0.87 NUDT1 (0.37) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL30060700 0.87 NUDT1 (0.37) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL278543 0.87 NUDT1 (0.37) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL15253181 0.87 NUDT1 (0.39) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL3184220 0.84 NUDT1 (0.40) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL8975998 0.83 LNPEP (0.39) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL5481982 0.83 NUDT1 (0.39) NUDT1BACE1HSP90AA1PSMB5CYP1A2
SCHEMBL27626 0.82 NUDT1 (0.37) NUDT1BACE1HSP90AA1PSMB5CYP1A2

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
EP-2077291-B1 BIS(AMINOPHENOL) DERIVATIVE, PROCESS FOR PRODUCING THE SAME, POLYAMIDE RESIN, POSITIVE PHOTOSENSITIVE RESIN COMPOSITIONS, PROTECTIVE FILM, INTERLAYER DIELECTRIC, SEMICONDUCTOR DEVICE, AND DISPLAY ELEMENT SUMITOMO BAKELITE CO (JP) 2013-01-09 EP disclosed
US-8269358-B2 Bis(aminophenol) derivative, process for producing same, polyamide resin, positive photosensitive resin composition, protective film, interlayer dielectric film, semiconductor device, and display element SUMITOMO BAKELITE COMPANY LIMITED (JP) 2012-09-18 US disclosed
US-20100044888-A1 BIS(AMINOPHENOL) DERIVATIVE, PROCESS FOR PRODUCING SAME, POLYAMIDE RESIN, POSITIVE PHOTOSENSITIVE RESIN COMPOSITION, PROTECTIVE FILM, INTERLAYER DIELECTRIC FILM, SEMICONDUCTOR DEVICE, AND DISPLAY ELEMENT SUMITOMO BAKELITE COMPANY LIMITED (JP) 2010-02-25 US disclosed
EP-2077291-A1 BIS(AMINOPHENOL) DERIVATIVE, PROCESS FOR PRODUCING THE SAME, POLYAMIDE RESIN, POSITIVE PHOTOSENSITIVE RESIN COMPOSITIONS, PROTECTIVE FILM, INTERLAYER DIELECTRIC, SEMICONDUCTOR DEVICE, AND DISPLAY ELEMENT Sumitomo Bakelite Company, Ltd. (JP) 2009-07-08 EP disclosed
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
EP-1375463-A1 OPTICALLY ACTIVE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Kansai Research Institute, Inc. (JP) 2004-01-02 EP disclosed
US-20030211421-A1 Optically active compound and photosensitive resin composition KRI, INC. (JP) 2003-11-13 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-20100044888-A1 BIS(AMINOPHENOL) DERIVATIVE, PROCESS FOR PRODUCING SAME, POLYAMIDE RESIN, POSITIVE PHOTOSENSITIVE RESIN COMPOSITION, PROTECTIVE FILM, INTERLAYER DIELECTRIC FILM, SEMICONDUCTOR DEVICE, AND DISPLAY ELEMENT RARA, AASDHPPT, GABRP NUDT1 1030/4885BACE1 4114/4885HSP90AA1 502/4885
US-20030211421-A1 Optically active compound and photosensitive resin composition ARCN1, RAD51, PAM NUDT1 1116/4885BACE1 1553/4885HSP90AA1 556/4885

“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.