SCHEMBL16156846

SCHEMBL16156846

CC(C)(C)c1ccc2c(c1)c1ccccc1n2CCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 3/20 0.69
▸ FABP5 Q01469 3/20 0.69
▸ FABP3 P05413 1/20 0.69
▸ ALDH1A1 P00352 3/20 0.56
▸ KDM4E B2RXH2 4/20 0.56
▸ HPGD P15428 1/20 0.52
▸ PGR P06401 1/20 0.52
▸ RORA P35398 1/20 0.52
▸ RORC P51449 1/20 0.52
▸ RORB Q92753 1/20 0.52
▸ DNMT1 P26358 3/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.49
▸ APEX1 P27695 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CNR2 P34972 1/20 0.47
▸ TBXAS1 P24557 1/20 0.46

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
SCHEMBL17482014 0.86 KDM4E (0.61) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL30549325 0.83 FABP4 (1.00) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL150033 0.83 FABP4 (1.00) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL17482066 0.83 FABP4 (0.73) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL27763456 0.82 FABP4 (0.96) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL16156852 0.80 FABP4 (0.73) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL16156860 0.80 FABP4 (0.73) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL27543262 0.80 FABP4 (0.73) FABP4FABP5FABP3ALDH1A1KDM4E
SCHEMBL2600054 0.77 MAPT (0.63) ALDH1A1KDM4EHPGDPGRRORA
SCHEMBL31053768 0.76 FABP4 (0.61) FABP4FABP5FABP3ALDH1A1KDM4E

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
US-9862684-B2 Modulation of K2P channels THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-01-09 — — US disclosed
US-9862684-B2 Modulation of K2P channels THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-01-09 — — US disclosed
US-20160031814-A1 MODULATION OF K2P CHANNELS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-04 — — US disclosed
US-20160031814-A1 MODULATION OF K2P CHANNELS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-04 — — US disclosed
US-20160031814-A1 MODULATION OF K2P CHANNELS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-04 — — US disclosed
WO-2014165307-A9 MODULATION OF K2P CHANNELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-11-27 — — WO disclosed
WO-2014165307-A2 MODULATION OF K2P CHANNELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-10-09 — — WO 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-20160031814-A1 MODULATION OF K2P CHANNELS KCNJ2, KCNK2, KCNN3 FABP4 3351/4885FABP5 2617/4885FABP3 3052/4885

“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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