SCHEMBL2791871

SCHEMBL2791871

O=CC1(c2ccccc2)CCCCC1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.39
MAOA P21397 6/20 0.39
MAOB P27338 6/20 0.39
AKR1C1 Q04828 1/20 0.36
SLC6A9 P48067 3/20 0.36
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL28008797 0.79 AKR1C1 (0.41) AKR1C1SLC6A4SLC6A3
SCHEMBL1033763 0.75 TSHR (0.40) KDM1AMAOAMAOBSLC6A9OPRM1
SCHEMBL5328740 0.75 KDM1A (0.42) KDM1AMAOAMAOBAKR1C1SLC6A9
SCHEMBL9295240 0.74 KDM1A (0.44) KDM1AMAOAMAOBSLC6A2SLC6A4
SCHEMBL31143852 0.73 KDM1A (0.43) KDM1AMAOAMAOB
SCHEMBL19772436 0.72 SLC6A4 (0.45) OPRM1SLC6A2SLC6A4
SCHEMBL2481698 0.71 KDM1A (0.59) KDM1AMAOAMAOB
SCHEMBL6735371 0.71 KDM1A (0.42) KDM1AMAOAMAOBSLC6A2SLC6A4
SCHEMBL29209554 0.71 KDM1A (0.42) KDM1AMAOAMAOBSLC6A2SLC6A4
SCHEMBL1248050 0.71 KDM1A (0.44) KDM1AMAOAMAOBSLC6A2SLC6A4

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-2175320-B1 ALKALI-DEVELOPABLE PHOTOSENSITIVE RESIN COMPOSITION ADEKA CORP (JP) 2013-03-13 EP disclosed
US-8338081-B2 Alkali-developable photosensitive resin composition and β-diketone compound ADEKA CORPORATION (JP) 2012-12-25 US disclosed
US-20100129753-A1 ALKALI-DEVELOPABLE PHOTOSENSITIVE RESIN COMPOSITION AND BETA-DIKETONE COMPOUND ADEKA CORPORATION (JP) 2010-05-27 US disclosed
EP-2175320-A1 ALKALI-DEVELOPABLE PHOTOSENSITIVE RESIN COMPOSITION AND -DIKETONE COMPOUND Adeka Corporation (JP) 2010-04-14 EP disclosed
US-7695895-B2 photopolymerizable unsaturated binder obtained by adding unsaturated monobasic acid polyfunctional epoxy resin to form epoxy adduct and allowing epoxy adduct and polybasic acid anhydride to react; color filters, liquid crystal displays, image sensors TOPPAN PRINTING CO., LTD. (JP) 2010-04-13 US disclosed
EP-1906243-A1 ALKALINE-DEVELOPABLE PHOTOSENSITIVE COLORED COMPOSITION Toppan Printing Co., Ltd. (JP) 2008-04-02 EP disclosed
US-20070292805-A1 photopolymerizable unsaturated binder obtained by adding unsaturated monobasic acid polyfunctional epoxy resin to form epoxy adduct and allowing epoxy adduct and polybasic acid anhydride to react; color filters, liquid crystal displays, image sensors ADEKA CORPORATION (JP) 2007-12-20 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-20100129753-A1 ALKALI-DEVELOPABLE PHOTOSENSITIVE RESIN COMPOSITION AND BETA-DIKETONE COMPOUND RPS14, ACAD11, OR10J3 KDM1A 759/4885MAOA 4436/4885MAOB 3620/4885

“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.