SCHEMBL9875684

SCHEMBL9875684

CC(O)c1ccc(OC2CCCCO2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
TNK2 Q07912 3/20 0.37
SLC6A3 Q01959 8/20 0.36
ACACB O00763 1/20 0.35
DHFR P00374 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL7774785 0.88 KMT2A (0.40) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL7231881 0.88 KMT2A (0.40) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL20032688 0.88 MEN1 (0.40) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL14366810 0.84 HSD11B1 (0.39) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL11772440 0.84 ABCB11 (0.39) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL15869184 0.84 TNK2 (0.40) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL4390019 0.84 TNK2 (0.40) HSD11B1KMT2AMEN1TNK2SLC6A3
SCHEMBL3500438 0.83 TNK2 (0.44) HSD11B1KMT2AMEN1TNK2DHFR
SCHEMBL14049220 0.82 ALDH1A1 (0.43) KMT2AMEN1TNK2DHFR
SCHEMBL825397 0.82 ALDH1A1 (0.43) KMT2AMEN1TNK2DHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9618844-B2 Reagent and composition of resist TOYO GOSEI CO., LTD. (JP) 2017-04-11 US disclosed
US-9618844-B2 Reagent and composition of resist TOYO GOSEI CO., LTD. (JP) 2017-04-11 US disclosed
US-20160195808-A1 REAGENT FOR ENHANCING GENERATION OF CHEMICAL SPECIES TOYO GOSEI CO LTD (JP) 2016-07-07 US disclosed
US-20160195808-A1 REAGENT FOR ENHANCING GENERATION OF CHEMICAL SPECIES TOYO GOSEI CO LTD (JP) 2016-07-07 US disclosed
US-20160159953-A1 REAGENT FOR ENHANCING GENERATION OF CHEMICAL SPECIES TOYO GOSEI CO LTD (JP) 2016-06-09 US disclosed
US-20160159953-A1 REAGENT FOR ENHANCING GENERATION OF CHEMICAL SPECIES TOYO GOSEI CO LTD (JP) 2016-06-09 US disclosed
US-20160070165-A1 REAGENT AND COMPOSITION OF RESIST OSAKA UNIVERSITY (JP) 2016-03-10 US disclosed
US-20160070165-A1 REAGENT AND COMPOSITION OF RESIST OSAKA UNIVERSITY (JP) 2016-03-10 US disclosed
US-5053507-A Liquid crystal dopants ARAKAWA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-10-01 US disclosed
US-3940407-A β-Adrenergic blocking agents in the 1,2,3-thiadiazole series SYNTEX (U.S.A.) INC. (US) 1976-02-24 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-20160070165-A1 REAGENT AND COMPOSITION OF RESIST ALAD, POLRMT, POLL HSD11B1 3383/4885KMT2A 1839/4885MEN1 2028/4885

“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.