SCHEMBL6763904

SCHEMBL6763904

CC(C)CC(O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ SRC P12931 1/20 0.43
▸ CYP2D6 P10635 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ GRIN2D O15399 2/20 0.40
▸ GRIN1 Q05586 2/20 0.40
▸ GRIN2A Q12879 2/20 0.40
▸ GRIN2B Q13224 2/20 0.40
▸ GRIN2C Q14957 2/20 0.40
▸ OPRM1 P35372 2/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ CACNA1F O60840 1/20 0.40
▸ ABCB1 P08183 1/20 0.40
▸ CYP2B6 P20813 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ OPRK1 P41145 1/20 0.40

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
SCHEMBL3652874 0.83 CYP2D6 (0.48) SMN1; SMN2GAACYP2D6CYP1A2GRIN2D
SCHEMBL4953088 0.80 SMN1; SMN2 (0.45) CES1SMN1; SMN2GAASRCCYP2D6
SCHEMBL390943 0.79 CES1 (0.52) CES1SMN1; SMN2SRCCYP2C19HIF1A
SCHEMBL11789186 0.79 CES1 (0.50) CES1SMN1; SMN2SRCCYP1A2CYP2C19
SCHEMBL476563 0.78 CES1 (0.47) CES1SMN1; SMN2GAASRCCYP2D6
SCHEMBL6321356 0.78 CHRM2 (0.48) CES1SMN1; SMN2SRCCYP2D6CYP1A2
SCHEMBL6200772 0.78 CES1 (0.44) CES1SMN1; SMN2GAASRCCYP2D6
SCHEMBL8462452 0.78 CES1 (0.45) CES1SMN1; SMN2GAASRCCYP2D6
SCHEMBL4810206 0.78 CES1 (0.44) CES1SMN1; SMN2GAASRCCYP2D6
SCHEMBL4009225 0.77 KCNN4 (0.55) CES1SMN1; SMN2GAASRCCYP2D6

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
CN-110073470-A Semiconductor machining adhesive tape 古河电气工业株式会社 2019-07-30 — — CN disclosed
US-9926276-B2 Substituted benzamides with activity towards EP4 receptors DRACONIS PHARMA, S.L. (ES) 2018-03-27 — — US disclosed
CN-107431007-A The back side grinding surface protection tape of semiconductor wafer and the grinding processing method of semiconductor wafer 古河电气工业株式会社 2017-12-01 — — CN disclosed
US-20150376129-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS DRACONIS PHARMA, S.L. (ES) 2015-12-31 — — US disclosed
US-6730765-B1 CURABLE ORGANOSILOXANE OLIGOMERS CONTAIN MALEAMIC ACID FUNCTIONALITY NCR CORPORATION 2004-05-04 — — US disclosed
US-5565246-A THERMOGRAPHY BIOMETRIC IMAGING INC. 1996-10-15 — — US disclosed
US-4112182-A CELLULOSE ESTER ARTICLE COATED WITH RADIATION CURABLE UNSATURATED CELLULOSE ESTER- ACRYLATE EASTMAN KODAK COMPANY (US) 1978-09-05 — — 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-20150376129-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS PTGER4, PTGER1, PTGER2 CES1 544/4885SMN1; SMN2 4035/4885GAA 2950/4885

“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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