SCHEMBL10356261

SCHEMBL10356261

Cc1ccc(-c2c(C)c(O)nn2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 8/20 0.45
TDP2 O95551 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
CNR1 P21554 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
ESRRA P11474 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
ACHE P22303 1/20 0.34
USP7 Q93009 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL22492837 0.85 GRM5 (0.46) GRM5MAPTPOLB
SCHEMBL23399541 0.83 GRM5 (0.38) GRM5TDP2SIRT1CNR1TDP1
SCHEMBL22510565 0.82 GRM5 (0.49) GRM5TDP1KDM4CALDH1A1MAPT
SCHEMBL14996604 0.80 GRM5 (0.43) GRM5TDP2SIRT1CNR1TDP1
SCHEMBL23400373 0.79 TGFBR1 (0.42) GRM5TDP2ACHEALDH1A1SMN1; SMN2
SCHEMBL23401734 0.79 GRM5 (0.36) GRM5TDP2SIRT1CNR1TDP1
SCHEMBL23399628 0.79 GRM5 (0.39) GRM5USP7ALDH1A1MAPTPOLB
SCHEMBL23400332 0.78 MAPT (0.44) CNR1TDP1ALDH1A1MAPTSMN1; SMN2
SCHEMBL23399699 0.78 TDP1 (0.46) GRM5TDP1ALDH1A1MAPTPOLB
SCHEMBL23402647 0.78 TDP1 (0.46) GRM5TDP1ALDH1A1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed
US-8222280-B2 Ether compounds with nitrogen-containing 5-member heterocycle and uses thereof SINOCHEM CORPORATION (CN) 2012-07-17 US disclosed
US-8222280-B2 Ether compounds with nitrogen-containing 5-member heterocycle and uses thereof SINOCHEM CORPORATION (CN) 2012-07-17 US disclosed
US-20110178149-A1 Ether Compounds with Nitrogen-Containing 5-Member Heterocycle and Uses Thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2011-07-21 US disclosed
US-20110178149-A1 Ether Compounds with Nitrogen-Containing 5-Member Heterocycle and Uses Thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2011-07-21 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-20110178149-A1 Ether Compounds with Nitrogen-Containing 5-Member Heterocycle and Uses Thereof MLX, NT5C3B, PGLS GRM5 327/4885TDP2 4485/4885SIRT1 1440/4885

“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.