SCHEMBL3369268

SCHEMBL3369268

C=C(CCOC12CC3CC(CC(C3)C1)C2)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
NPSR1 Q6W5P4 3/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP2C9 P11712 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDM4E B2RXH2 2/20 0.33
TSHR P16473 2/20 0.33
EPHX2 P34913 3/20 0.32
CYP19A1 P11511 1/20 0.32
ATM Q13315 1/20 0.32
GLA P06280 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6902701 0.82 ALDH1A1 (0.35) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL1499943 0.82 HTT (0.44) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL3939208 0.77 ALDH1A1 (0.38) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL19798443 0.77 ALDH1A1 (0.46) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL2409327 0.74 EPHX2 (0.44) ALDH1A1NPSR1MEN1KMT2ATSHR
SCHEMBL22615613 0.72 CYP19A1 (0.44) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL14691655 0.70 POLB (0.39) ALDH1A1MEN1KMT2ATSHRGAA
SCHEMBL22186501 0.70 ALDH1A1 (0.40) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL14962543 0.70 THRB (0.46) ALDH1A1NPSR1HTTMEN1KMT2A
SCHEMBL1072125 0.70 ALDH1A1 (0.39) ALDH1A1NPSR1HTTMEN1KMT2A

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-20100022730-A1 POLYMERIZABLE COMPOUND HAVING ADAMANTANE STRUCTURE, PROCESS FOR PRODUCTION OF THE SAME, AND RESIN COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2010-01-28 US disclosed
WO-2009019574-A1 PHOTORESIST COMPOSITION FOR DEEP UV AND PROCESS THEREOF AZ ELECTRONIC MATERIALS USA CORP. (DE) 2009-02-12 WO disclosed
US-20090042148-A1 Photoresist Composition for Deep UV and Process Thereof AZ ELECTRONIC MATERIALS USA CORP. 2009-02-12 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-20100022730-A1 POLYMERIZABLE COMPOUND HAVING ADAMANTANE STRUCTURE, PROCESS FOR PRODUCTION OF THE SAME, AND RESIN COMPOSITION ADAM9, ADAM17, PADI1 ALDH1A1 416/4885NPSR1 715/4885HTT 4020/4885

“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.