SCHEMBL1716319

SCHEMBL1716319

CC(C)C(C(=O)O)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 2/20 0.43
EPHX1 P07099 7/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
MMP2 P08253 2/20 0.40
CA9 Q16790 2/20 0.40
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
DPP4 P27487 1/20 0.36
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
EPHX2 P34913 1/20 0.35
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL5519131 1.00 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1EPHX1CA12CA1
SCHEMBL5512591 1.00 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1EPHX1CA12CA1
SCHEMBL15668891 0.85 EPHX1 (0.48) SMN1; SMN2ALDH1A1EPHX1CYP2C9CYP2C19
SCHEMBL7120046 0.85 EPHX1 (0.48) SMN1; SMN2ALDH1A1EPHX1CYP2C9CYP2C19
SCHEMBL19690600 0.85 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1EPHX1CA12CA1
SCHEMBL16586374 0.84 EPHX1 (0.40) SMN1; SMN2ALDH1A1EPHX1CA12CA1
SCHEMBL10599727 0.84 EPHX1 (0.40) SMN1; SMN2ALDH1A1EPHX1CA12CA1
SCHEMBL30093936 0.83 EPHX1 (0.44) SMN1; SMN2ALDH1A1EPHX1CYP2C9CYP2C19
SCHEMBL6843635 0.83 EPHX1 (0.43) SMN1; SMN2ALDH1A1EPHX1CA12CA1
SCHEMBL10879040 0.83 ATM (0.41) SMN1; SMN2ALDH1A1EPHX1CA12CA1

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716159-B1 BICYCLIC SILOXANE COMPOSITIONS FOR THE RELEASE OF ACTIVE INGREDIENTS MOMENTIVE PERFORMANCE MAT INC (US) 2011-07-13 EP claimed
EP-1697386-B1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES GEN ELECTRIC (US) 2007-10-10 EP claimed
US-20250195518-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2025-06-19 US disclosed
EP-4488271-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Japan Tobacco Inc. (JP) 2025-01-08 EP disclosed
US-20240244957-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL Merck Patent KGaA (DE) 2024-07-18 US disclosed
EP-3475372-B1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-11-22 EP disclosed
EP-3807367-B1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-07-19 EP disclosed
US-20230151235-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-11603479-B2 Formulation of an organic functional material MERCK KGAA (DE) 2023-03-14 US disclosed
US-11407907-B2 Formulation of an organic functional material MERCK PATENT GMBH (DE) 2022-08-09 US disclosed
EP-2145042-B2 TEXTILE SCENTING HENKEL AG & CO KGAA (DE) 2021-10-06 EP disclosed
US-7332489-B2 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2008-02-19 US disclosed
WO-2008012140-A1 LIQUID SUPPORT HENKEL AG & CO. KGAA (DE) 2008-01-31 WO disclosed
WO-2008003631-A1 WASHING, CLEANING AND CARE PRODUCTS HENKEL AG & CO. KGAA (DE) 2008-01-10 WO disclosed
US-7238692-B2 Medical devices employing triazine compounds and compositions thereof REDDY US THERAPEUTICS, INC. (US) 2007-07-03 US disclosed
US-7238692-B2 Medical devices employing triazine compounds and compositions thereof REDDY US THERAPEUTICS, INC. (US) 2007-07-03 US disclosed
US-20070117795-A1 Methods and compositions of novel triazine compounds DR. REDDY'S LABORATORIES LTD. (IN) 2007-05-24 US disclosed
US-20070099874-A1 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2007-05-03 US disclosed
WO-2007028477-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
US-7169785-B2 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2007-01-30 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 (3 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-20070099874-A1 Methods and compositions of novel triazine compounds AREG, TGFB1, PTGIS SMN1; SMN2 4172/4885ALDH1A1 4407/4885EPHX1 3431/4885
US-20250195518-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF HPGDS, PTGIS, HPGD SMN1; SMN2 4662/4885ALDH1A1 475/4885EPHX1 1169/4885
US-20070117795-A1 Methods and compositions of novel triazine compounds AREG, TGFB1, PTGIS SMN1; SMN2 4172/4885ALDH1A1 4407/4885EPHX1 3431/4885

“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.