SCHEMBL6537130

SCHEMBL6537130

CC(C)(C)N1SCC(c2ccccc2)(c2ccccc2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ OPRM1 P35372 3/20 0.38
▸ GRIN1 Q05586 3/20 0.38
▸ GRIN2A Q12879 3/20 0.38
▸ GRIN2D O15399 1/20 0.38
▸ GRIN3B O60391 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ GRIN2C Q14957 1/20 0.38
▸ GRIN3A Q8TCU5 1/20 0.38
▸ CNR1 P21554 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ OPRK1 P41145 1/20 0.32
▸ OPRL1 P41146 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ BACE1 P56817 2/20 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
SCHEMBL10576643 0.68 BACE1 (0.39) ALDH1A1GRIN1GRIN2AKCNH2CNR1
SCHEMBL10575710 0.67 ALDH1A1 (0.41) ALDH1A1GRIN1GRIN2ACNR1SMN1; SMN2
SCHEMBL6536927 0.66 ALDH1A1 (0.38) ALDH1A1OPRM1GRIN1GRIN2AGRIN2D
SCHEMBL6536948 0.65 ALDH1A1 (0.37) ALDH1A1OPRM1GRIN1GRIN2AGRIN2D
SCHEMBL10576467 0.65 BACE1 (0.43) CNR1POLBGPR55BACE1BACE2
SCHEMBL10604466 0.65 CNR1 (0.35) ALDH1A1OPRM1GRIN1GRIN2ACHRM2
SCHEMBL10607948 0.63 ALDH1A1 (0.38) ALDH1A1OPRM1CNR1SMN1; SMN2OPRK1
SCHEMBL28644761 0.62 KCNH2 (0.42) ALDH1A1OPRM1GRIN1GRIN2AGRIN2D
SCHEMBL30929784 0.61 GRIN1 (0.57) ALDH1A1OPRM1GRIN1GRIN2AGRIN2D
SCHEMBL10607870 0.60 ALDH1A1 (0.42) ALDH1A1CNR1SMN1; SMN2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696234-B2 Silver halide photosensitive material and isothiazolidine-3-one derivative FUJI PHOTO FILM CO., LTD. (JP) 2004-02-24 — — US disclosed
US-20030190566-A1 Silver halide photosensitive material and isothiazolidine-3-one derivative FUJI PHOTO FILM CO., LTD. 2003-10-09 — — 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-20030190566-A1 Silver halide photosensitive material and isothiazolidine-3-one derivative NRP1, NR2E3, SCN1B ALDH1A1 172/4885OPRM1 2184/4885GRIN1 17/4885

“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.

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