SCHEMBL4415635

SCHEMBL4415635

C(=Cc1ccccc1)OCCOC1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
CHRNA7 P36544 3/20 0.39
CHRNB4 P30926 2/20 0.39
CHRNA3 P32297 2/20 0.39
CHRNA10 Q9GZZ6 2/20 0.39
CHRNA9 Q9UGM1 2/20 0.39
OPRM1 P35372 1/20 0.39
HPGD P15428 1/20 0.38
DPP4 P27487 1/20 0.37
HSP90AA1 P07900 2/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
SIGMAR1 Q99720 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
SCHEMBL4421635 0.98 OPRM1 (0.40) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL29266721 0.79 KDM4E (0.41) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL13686299 0.79 MAOB (0.48) CHRNA7CHRNB4CHRNA3CHRNA10CHRNA9
SCHEMBL21596560 0.79 AKR1B10 (0.40) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL23244045 0.76 HSP90AA1 (0.42) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL1397152 0.76 HSP90AA1 (0.42) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL27995144 0.76 SIGMAR1 (0.52) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL27608173 0.74 CHRNB4 (0.42) KDM4ECHRNA7CHRNB4CHRNA3CHRNA10
SCHEMBL1397198 0.74 CYP19A1 (0.43) KDM4EHPGDHSP90AA1MAPK1SMN1; SMN2
SCHEMBL8335852 0.71 HPGD (0.51) HPGDSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270553-B1 Acid generator, sulfonic acid, sulfonic acid derivatives and radiation-sensitive resin composition JSR CORP (JP) 2009-11-18 EP disclosed
US-6908722-B2 Acid generator, sulfonic acid, sulfonic acid derivatives and radiation-sensitive resin composition JSR CORPORATION (JP) 2005-06-21 US disclosed
US-20030113658-A1 Acid generator, sulfonic acid, sulfonic acid derivatives and radiation-sensitive resin composition JSR CORPORATION (JP) 2003-06-19 US disclosed
EP-1270553-A2 Acid generator, sulfonic acid, sulfonic acid derivatives and radiation-sensitive resin composition JSR Corporation (JP) 2003-01-02 EP disclosed
EP-1059314-A1 A resist composition Wako Pure Chemical Industries, Ltd. (JP) 2000-12-13 EP disclosed
EP-1059563-A1 Agent for reducing substrate dependence of resist Wako Pure Chemical Industries, Ltd. (JP) 2000-12-13 EP 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-20030113658-A1 Acid generator, sulfonic acid, sulfonic acid derivatives and radiation-sensitive resin composition ASIC1, PFAS, RARA KDM4E 4264/4885CHRNA7 1191/4885CHRNB4 2428/4885

“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.