SCHEMBL1550342

SCHEMBL1550342

COP(=O)(CC(=O)c1cnn(C(C)(C)C)c1C)OC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 1/20 0.33
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3180171 0.83 TRPV4 (0.33) TRPV4
SCHEMBL2322538 0.83 TRPA1 (0.39) CYP2C19ALDH1A1HPGDHSD17B10NPC1
SCHEMBL2329877 0.81 TP53 (0.40) TRPV4ALDH1A1LMNAHSD17B10TP53
SCHEMBL1550345 0.80 TSHR (0.33) TRPV4CYP3A4CYP2C19ALDH1A1LMNA
SCHEMBL2329024 0.80 ALDH1A1 (0.41) ALDH1A1LMNAHPGDHSD17B10NPC1
SCHEMBL1550333 0.75 MAPK1 (0.58) ALDH1A1LMNAHPGDNPC1RAB9A
SCHEMBL1406667 0.74 KMT2A (0.49) TRPV4CYP2C19ALDH1A1LMNAHPGD
SCHEMBL574545 0.73 RAB9A (0.48) CYP3A4CYP2C19ALDH1A1LMNAHPGD
SCHEMBL2325459 0.73 SMN1; SMN2 (0.48) ALDH1A1LMNAHPGDHSD17B10NPC1
SCHEMBL2326711 0.72 ALDH1A1 (0.33) CYP2C19ALDH1A1LMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501940-B2 Tetrahydrocinnoline derivatives HOFFMANN-LA ROCHE INC. (US) 2013-08-06 — — US disclosed
EP-1904455-B1 PYRIDAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-08-17 — — EP disclosed
EP-2313375-A1 TETRAHYDROCINNOLINES AS 11 BETA HSD1 INHIBITORS FOR DIABETES F. Hoffmann-La Roche AG (CH) 2011-04-27 — — EP disclosed
US-7678795-B2 Pyridazines as 11b-HSD1 inhibitors HOFFMAN-LA ROCHE INC. (US) 2010-03-16 — — US disclosed
WO-2010006940-A1 TETRAHYDROCINNOLINES AS 11 BETA HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2010-01-21 — — WO disclosed
US-20100016325-A1 TETRAHYDROCINNOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2010-01-21 — — US disclosed
EP-1904455-A2 PYRIDAZINE DERIVATIVES F. Hoffmann-Roche AG (CH) 2008-04-02 — — EP disclosed
WO-2007003521-A2 PYRIDAZINE DERIVATIVES AS 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-01-11 — — WO disclosed
US-20070010519-A1 New pyridazines as 11B-HSD1 inhibitors HOFFMANN-LA ROCHE INC. 2007-01-11 — — 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 (2 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-20100016325-A1 TETRAHYDROCINNOLINE DERIVATIVES CYP27A1, CYP11B1, DHCR7 TRPV4 3427/4885CYP3A4 114/4885CYP2C19 69/4885
US-20070010519-A1 New pyridazines as 11B-HSD1 inhibitors HSD11B1, HSD17B1, HSD17B11 TRPV4 4130/4885CYP3A4 60/4885CYP2C19 51/4885

“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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